From 0da88032fe911501c0f36a5185ab36887e05f8b4 Mon Sep 17 00:00:00 2001 From: Alex Selimov Date: Wed, 26 Jan 2022 20:28:53 -0500 Subject: [PATCH] Updates to typeseting building scripts and templates --- mkdoc | 37 - presentation.tex | 72 +- presentation_metropolis.tex | 59 + references.bib | 2712 ++++++++++++++++++++++++++++------- scripts/md2beamer | 2 +- scripts/md2pdf | 2 +- 6 files changed, 2285 insertions(+), 599 deletions(-) delete mode 100755 mkdoc create mode 100644 presentation_metropolis.tex diff --git a/mkdoc b/mkdoc deleted file mode 100755 index e1f6c15..0000000 --- a/mkdoc +++ /dev/null @@ -1,37 +0,0 @@ -#!/bin/bash - -#This is a script to make document directories and copies template files over - -function fail { - printf '%s\n' "$1" >&2 - exit "${2-1}" -} - -#Make the new project directory -if [ ! -d $1 ]; then - mkdir $1 || fail "Failed making project directory exiting script" -fi - -#Set up the file structures -cd $1 - -if [ ! -d Figures ]; then - mkdir Figures -fi - - -case $2 in -"article") - cp ~/typesetting/article.md . ;; -"pres") - cp ~/typesetting/pres.md . ;; -"larticle") - cp ~/typesetting/article.tex ~/typesetting/GTLogo.pdf . ;; -"presentation") - cp ~/typesetting/presentation.tex ~/typesetting/GTLogo.pdf . ;; -"notes") - cp ~/typesetting/notes.md . ;; -*) - fail "$2 does not have a template" -esac - diff --git a/presentation.tex b/presentation.tex index 02f0bf8..ee6c69b 100644 --- a/presentation.tex +++ b/presentation.tex @@ -1,51 +1,73 @@ -\documentclass[11pt]{beamer} +\documentclass[12pt]{beamer} -\usetheme[progressbar=foot]{metropolis} +\usetheme{auriga} +\usecolortheme{auriga} -%\usepackage{fontspec} -%\setmainfont{Source Serif Pro} -%\setsansfont{Source Sans Pro} +\usepackage{enumitem} +\setitemize{itemsep=0.1em} +\setlist[itemize,1]{label=$\bullet$} +\usepackage{fontspec} \setmonofont{Source Code Pro} -%Define the Colors -\definecolor{main}{HTML}{192E5B} -\definecolor{alert}{HTML}{0AAFF1} -\definecolor{deepgreen}{rgb}{0,0.5,0} -\definecolor{deepblue}{rgb}{0,0,0.5} \usepackage{appendixnumberbeamer} -\setbeamercolor{background canvas}{bg=white} -\setbeamercolor{normal text}{bg=white, fg=main} -\setbeamercolor{alerted text}{bg=white, fg=alert} -\setbeamercolor{block title}{bg=white,fg=alert} -\setbeamercolor{block body}{bg=white} +\setbeamerfont{caption}{size=\footnotesize} %New bullet points -\setbeamertemplate{itemize item}[circle] +%\setbeamertemplate{itemize item}[circle] \usepackage[url=false,doi=false,isbn=false]{biblatex} -\usepackage{listings} -\lstset{basicstyle=\ttfamily\tiny\color{black},breaklines=true,backgroundcolor=\color{lightgray}, - numbers=left, stepnumber=1, commentstyle=\color{red}, keywordstyle=\color{blue}|, - escapeinside=||, stringstyle=\color{deepgreen}, emphstyle=\ttb\color{deepblue} } \usepackage{booktabs} \usepackage[scale=2]{ccicons} \usepackage{subcaption} \usepackage{pgfplots} \usepackage{xspace} +\usepackage{siunitx} % Required for alignment +\sisetup{ + round-mode = places, % Rounds numbers + round-precision = 2, % to 2 places +} +\usepackage{booktabs} \usepgfplotslibrary{dateplot} \pgfplotsset{compat=1.16} -\bibliography{/home/aselimov/latex/references} +\bibliography{/home/aselimov/typesetting/references} \setbeamertemplate{bibliography item}{\insertbiblabel} -\setbeamerfont{footnote}{size=\scriptsize} -\setbeamerfont{frametitle}{size=\LARGE} +\setbeamerfont{footnote}{size=\tiny} +\definecolor{red}{RGB}{181, 23, 0} +\definecolor{blue}{RGB}{0, 118, 186} +\definecolor{gray}{RGB}{146, 146, 146} + +\usepackage[labelformat=empty]{caption} + +\DeclareCiteCommand{\footpartcite}[\mkbibfootnote] + {\usebibmacro{prenote}} +{ \setunit{\addnbspace} + \printnames{labelname}% +%\setunit{\labelnamepunct} +% \printfield[citetitle]{title}% + \newunit + \printfield{year}} +{\addsemicolon\space} +{\usebibmacro{postnote}} + +\DeclareCiteCommand{\partcite} + {\usebibmacro{prenote}} +{ \setunit{\addnbspace} + \printnames{labelname}% +%\setunit{\labelnamepunct} +% \printfield[citetitle]{title}% + \newunit + \printfield{year}} +{\addsemicolon\space} +{\usebibmacro{postnote}} +\DeclareMultiCiteCommand{\partcites}{\partcite}{\addsemicolon\space} + \title{<++>} -% \date{\today} \date{\today} \author{Alex Selimov} \institute{Georgia Institute of Technology} -\titlegraphic{\hfill\includegraphics[height=1.5cm]{GTLogo.pdf}} +\titlegraphic{\hfill\includegraphics[height=1cm]{GTLogo.pdf}} \begin{document} diff --git a/presentation_metropolis.tex b/presentation_metropolis.tex new file mode 100644 index 0000000..02f0bf8 --- /dev/null +++ b/presentation_metropolis.tex @@ -0,0 +1,59 @@ +\documentclass[11pt]{beamer} + +\usetheme[progressbar=foot]{metropolis} + +%\usepackage{fontspec} +%\setmainfont{Source Serif Pro} +%\setsansfont{Source Sans Pro} +\setmonofont{Source Code Pro} +%Define the Colors +\definecolor{main}{HTML}{192E5B} +\definecolor{alert}{HTML}{0AAFF1} +\definecolor{deepgreen}{rgb}{0,0.5,0} +\definecolor{deepblue}{rgb}{0,0,0.5} +\usepackage{appendixnumberbeamer} +\setbeamercolor{background canvas}{bg=white} +\setbeamercolor{normal text}{bg=white, fg=main} +\setbeamercolor{alerted text}{bg=white, fg=alert} +\setbeamercolor{block title}{bg=white,fg=alert} +\setbeamercolor{block body}{bg=white} + +%New bullet points +\setbeamertemplate{itemize item}[circle] + +\usepackage[url=false,doi=false,isbn=false]{biblatex} +\usepackage{listings} +\lstset{basicstyle=\ttfamily\tiny\color{black},breaklines=true,backgroundcolor=\color{lightgray}, + numbers=left, stepnumber=1, commentstyle=\color{red}, keywordstyle=\color{blue}|, + escapeinside=||, stringstyle=\color{deepgreen}, emphstyle=\ttb\color{deepblue} } +\usepackage{booktabs} +\usepackage[scale=2]{ccicons} +\usepackage{subcaption} +\usepackage{pgfplots} +\usepackage{xspace} +\usepgfplotslibrary{dateplot} +\pgfplotsset{compat=1.16} + +\bibliography{/home/aselimov/latex/references} +\setbeamertemplate{bibliography item}{\insertbiblabel} +\setbeamerfont{footnote}{size=\scriptsize} +\setbeamerfont{frametitle}{size=\LARGE} + + +\title{<++>} +% \date{\today} +\date{\today} +\author{Alex Selimov} +\institute{Georgia Institute of Technology} +\titlegraphic{\hfill\includegraphics[height=1.5cm]{GTLogo.pdf}} + +\begin{document} + +\maketitle + +\begin{frame}{Overview} + \setbeamertemplate{section in toc}[sections numbered] + \tableofcontents%[hideallsubsections] +\end{frame} + +\end{document} diff --git a/references.bib b/references.bib index fa4e081..72df82f 100644 --- a/references.bib +++ b/references.bib @@ -1,3 +1,682 @@ +@article{1909.02030v3, + author = {Zepeda-Ruiz, Luis A. and Stukowski, Alexander and Oppelstrup, Tomas and Bertin, Nicolas and Barton, Nathan R. and Freitas, Rodrigo and Bulatov, Vasily V.}, + title = {Metal hardening in atomistic detail}, + year = {2019}, + month = {sep}, + url = {http://arxiv.org/abs/1909.02030v3}, + date = {2019-09-04T18:07:58Z}, + eprint = {1909.02030v3}, + eprintclass = {cond-mat.mtrl-sci}, + eprinttype = {arxiv}, + urldate = {2021-04-09T17:40:47.759973Z} +} + +@article{1950, + author = {Irving, J. H. and Kirkwood, John G.}, + title = {The Statistical Mechanical Theory of Transport Processes. IV. The Equations of Hydrodynamics}, + publisher = {AIP Publishing}, + year = {1950}, + month = {jun}, + number = {6}, + volume = {18}, + pages = {817--829}, + url = {https://doi.org/10.1063\%2F1.1747782}, + doi = {10.1063/1.1747782} +} + +@article{1951, + author = {Sylwestrowicz, W and Hall, E O}, + title = {The Deformation and Ageing of Mild Steel}, + publisher = {IOP Publishing}, + year = {1951}, + month = {jun}, + number = {6}, + volume = {64}, + pages = {495--502}, + url = {https://doi.org/10.1088\%2F0370-1301\%2F64\%2F6\%2F305}, + doi = {10.1088/0370-1301/64/6/305} +} + +@article{1967, + author = {Pino, Andrew De}, + title = {Helium Production by (n,$p̆alpha$) Reactions in Stainless Steel}, + publisher = {Informa UK Limited}, + year = {1967}, + month = {oct}, + number = {10}, + volume = {3}, + pages = {620--625}, + url = {https://doi.org/10.13182\%2Fnt67-a27921}, + doi = {10.13182/nt67-a27921} +} + +@article{1967a, + author = {Foreman, A. J. 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S.}, + title = {Yield stress of fine grained materials}, + publisher = {Elsevier BV}, + year = {1998}, + month = {aug}, + number = {13}, + volume = {46}, + pages = {4527--4534}, + url = {https://doi.org/10.1016\%2Fs1359-6454\%2898\%2900150-5}, + doi = {10.1016/s1359-6454(98)00150-5} +} + +@article{1999, + author = {Anderson, P. M. and Foecke, T. and Hazzledine, P. M.}, + title = {Dislocation-Based Deformation Mechanisms in Metallic Nanolaminates}, + publisher = {Springer Science and Business Media LLC}, + year = {1999}, + month = {feb}, + number = {2}, + volume = {24}, + pages = {27--33}, + url = {https://doi.org/10.1557\%2Fs0883769400051514}, + doi = {10.1557/s0883769400051514} +} + +@article{1999a, + author = {Anderson, P. M. and Rao, S. and Cheng, Y. and Hazzledine, P. 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Part II: Irradiation induced hardening}, + publisher = {Elsevier BV}, + year = {2004}, + month = {mar}, + number = {1}, + volume = {326}, + pages = {30--37}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2003.12.008}, + doi = {10.1016/j.jnucmat.2003.12.008} +} + +@article{2009, + author = {Pande, C. S. and Cooper, K. P.}, + title = {Nanomechanics of Hall–Petch relationship in nanocrystalline materials}, + publisher = {Elsevier BV}, + year = {2009}, + month = {aug}, + number = {6}, + volume = {54}, + pages = {689--706}, + url = {https://doi.org/10.1016\%2Fj.pmatsci.2009.03.008}, + doi = {10.1016/j.pmatsci.2009.03.008} +} + +@article{2010, + author = {Jiao, Z. and Was, G. 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J. and Misra, A.}, + title = {Interface dislocation patterns and dislocation nucleation in face-centered-cubic and body-centered-cubic bicrystal interfaces}, + publisher = {Elsevier BV}, + year = {2014}, + month = {feb}, + volume = {53}, + pages = {40--55}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2013.07.002}, + doi = {10.1016/j.ijplas.2013.07.002} +} + +@article{2015, + author = {Osetsky, Yuri N. and Stoller, Roger E.}, + title = {Atomic-scale mechanisms of helium bubble hardening in iron}, + publisher = {Elsevier BV}, + year = {2015}, + month = {oct}, + volume = {465}, + pages = {448--454}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2015.05.034}, + doi = {10.1016/j.jnucmat.2015.05.034} +} + +@article{2016, + author = {Cordero, Z. C. and Knight, B. E. and Schuh, C. A.}, + title = {Six decades of the Hall–Petch effect – a survey of grain-size strengthening studies on pure metals}, + publisher = {Informa UK Limited}, + year = {2016}, + month = {jul}, + number = {8}, + volume = {61}, + pages = {495--512}, + url = {https://doi.org/10.1080\%2F09506608.2016.1191808}, + doi = {10.1080/09506608.2016.1191808} +} + +@article{2016a, + author = {Abe, Yosuke and Tsuru, Tomohito and Shi, Shi and Oono, Naoko and Ukai, Shigeharu}, + title = {Effect of the dilation caused by helium bubbles on edge dislocation motion in $p̆alpha$-iron: molecular dynamics simulation}, + publisher = {Informa UK Limited}, + year = {2016}, + month = {jan}, + number = {10}, + volume = {53}, + pages = {1528--1534}, + url = {https://doi.org/10.1080\%2F00223131.2015.1133332}, + doi = {10.1080/00223131.2015.1133332} +} + +@article{2017, + author = {Huang, Sixie and Beyerlein, Irene J. and Zhou, Caizhi}, + title = {Nanograin size effects on the strength of biphase nanolayered composites}, + publisher = {Springer Science and Business Media LLC}, + year = {2017}, + month = {sep}, + number = {1}, + volume = {7}, + url = {https://doi.org/10.1038\%2Fs41598-017-10064-z}, + doi = {10.1038/s41598-017-10064-z} +} + +@article{2017a, + author = {He, Mo-Rigen and Johnson, Drew C. and Was, Gary S. and Robertson, Ian M.}, + title = {The role of grain boundary microchemistry in irradiation-assisted stress corrosion cracking of a Fe-13Cr-15Ni alloy}, + publisher = {Elsevier BV}, + year = {2017}, + month = {oct}, + volume = {138}, + pages = {61--71}, + url = {https://doi.org/10.1016\%2Fj.actamat.2017.07.042}, + doi = {10.1016/j.actamat.2017.07.042} +} + +@article{2018, + author = {Iguchi, Yusuke and Katona, Gábor L. and Cserháti, Csaba and Langer, Gábor A. and Erdélyi, Zoltán}, + title = {On the miscibility gap of Cu-Ni system}, + publisher = {Elsevier BV}, + year = {2018}, + month = {apr}, + volume = {148}, + pages = {49--54}, + url = {https://doi.org/10.1016\%2Fj.actamat.2018.01.038}, + doi = {10.1016/j.actamat.2018.01.038} +} + +@article{2018a, + author = {Yu, Huihui and Xin, Yunchang and Wang, Maoyin and Liu, Qing}, + title = {Hall-Petch relationship in Mg alloys: A review}, + publisher = {Elsevier BV}, + year = {2018}, + month = {feb}, + number = {2}, + volume = {34}, + pages = {248--256}, + url = {https://doi.org/10.1016\%2Fj.jmst.2017.07.022}, + doi = {10.1016/j.jmst.2017.07.022} +} + +@article{2018b, + author = {Qin, W. and Chauhan, A. K. and Szpunar, J. A.}, + title = {Helium bubble nucleation at grain boundaries and its influence on intergranular fracture}, + publisher = {Informa UK Limited}, + year = {2018}, + month = {dec}, + number = {6}, + volume = {99}, + pages = {679--698}, + url = {https://doi.org/10.1080\%2F14786435.2018.1551634}, + doi = {10.1080/14786435.2018.1551634} +} + +@article{2018c, + author = {Torres, E. and Pencer, J.}, + title = {Molecular dynamics study of the role of symmetric tilt grain boundaries on the helium distribution in nickel}, + publisher = {Elsevier BV}, + year = {2018}, + month = {apr}, + volume = {502}, + pages = {86--94}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2018.01.046}, + doi = {10.1016/j.jnucmat.2018.01.046} +} + +@article{2018d, + author = {Qin, W. and Chauhan, A. K. and Szpunar, J. A.}, + title = {Helium bubble nucleation at grain boundaries and its influence on intergranular fracture}, + publisher = {Informa UK Limited}, + year = {2018}, + month = {dec}, + number = {6}, + volume = {99}, + pages = {679--698}, + url = {https://doi.org/10.1080\%2F14786435.2018.1551634}, + doi = {10.1080/14786435.2018.1551634} +} + +@article{2019, + author = {Yoshida, Shuhei and Ikeuchi, Takuto and Bhattacharjee, Tilak and Bai, Yu and Shibata, Akinobu and Tsuji, Nobuhiro}, + title = {Effect of elemental combination on friction stress and Hall-Petch relationship in face-centered cubic high / medium entropy alloys}, + publisher = {Elsevier BV}, + year = {2019}, + month = {jun}, + volume = {171}, + pages = {201--215}, + url = {https://doi.org/10.1016\%2Fj.actamat.2019.04.017}, + doi = {10.1016/j.actamat.2019.04.017} +} + +@article{2019a, + author = {Chen, Shuying and Tseng, Ko-Kai and Tong, Yang and Li, Weidong and Tsai, Che-Wei and Yeh, Jien-Wei and Liaw, Peter K.}, + title = {Grain growth and Hall-Petch relationship in a refractory HfNbTaZrTi high-entropy alloy}, + publisher = {Elsevier BV}, + year = {2019}, + month = {jul}, + volume = {795}, + pages = {19--26}, + url = {https://doi.org/10.1016\%2Fj.jallcom.2019.04.291}, + doi = {10.1016/j.jallcom.2019.04.291} +} + +@article{2019b, + author = {Naik, Sneha N. and Walley, Stephen M.}, + title = {The Hall–Petch and inverse Hall–Petch relations and the hardness of nanocrystalline metals}, + publisher = {Springer Science and Business Media LLC}, + year = {2019}, + month = {nov}, + number = {7}, + volume = {55}, + pages = {2661--2681}, + url = {https://doi.org/10.1007\%2Fs10853-019-04160-w}, + doi = {10.1007/s10853-019-04160-w} +} + +@article{2019c, + author = {Sun, Xiangyu and Chen, Feida and Huang, Hai and Lin, Jiwei and Tang, Xiaobin}, + title = {Effects of interfaces on the helium bubble formation and radiation hardening of an austenitic stainless steel achieved by additive manufacturing}, + publisher = {Elsevier BV}, + year = {2019}, + month = {feb}, + volume = {467-468}, + pages = {1134--1139}, + url = {https://doi.org/10.1016\%2Fj.apsusc.2018.10.268}, + doi = {10.1016/j.apsusc.2018.10.268} +} + +@article{2020, + author = {Wan, L. and Ma, S. G. and Zhang, R. J. and Cao, X. Z. and Jin, S. X. and Ye, X. Q. and Gao, T.}, + title = {Molecular dynamics simulations of helium migration, diffusion behavior of helium bubbles, and melting point of single crystal in bulk $p̆gamma$-Fe}, + publisher = {Springer Science and Business Media LLC}, + year = {2020}, + month = {oct}, + number = {11}, + volume = {95}, + pages = {2375--2385}, + url = {https://doi.org/10.1007\%2Fs12648-020-01914-0}, + doi = {10.1007/s12648-020-01914-0} +} + +@article{2020a, + author = {Chen, Tianju and Yuan, Rui and Beyerlein, Irene J. and Zhou, Caizhi}, + title = {Predicting the size scaling in strength of nanolayered materials by a discrete slip crystal plasticity model}, + publisher = {Elsevier BV}, + year = {2020}, + month = {jan}, + volume = {124}, + pages = {247--260}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2019.08.016}, + doi = {10.1016/j.ijplas.2019.08.016} +} + +@article{2020b, + author = {Paccou, Elie and Tanguy, Benoît and Legros, Marc}, + title = {Irradiation-assisted stress corrosion cracking susceptibility and mechanical properties related to irradiation-induced microstructures of 304L austenitic stainless steel}, + publisher = {Elsevier BV}, + year = {2020}, + month = {jan}, + volume = {528}, + pages = {151880}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2019.151880}, + doi = {10.1016/j.jnucmat.2019.151880} +} + +@article{2021, + author = {Liu, Haocheng and Huang, Jia and Wang, Chenxu and Xia, Songqin and Ge, Wei and Liu, Qingyuan and Su, Yue and Gao, Zhiying and Zhao, Shuang and Du, Congcong and Cao, Liuxuan and Shen, Tongde and Wang, Yugang}, + title = {Effects of grain boundaries and nano-precipitates on helium bubble behaviors in lanthanum-doped nanocrystalline steel}, + publisher = {Elsevier BV}, + year = {2021}, + month = {jul}, + volume = {200}, + pages = {113900}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2021.113900}, + doi = {10.1016/j.scriptamat.2021.113900} +} + +@article{2021a, + author = {Jian, Wu-Rong and Su, Yanqing and Xu, Shuozhi and Ji, Weisen and Beyerlein, Irene J.}, + title = {Effect of interface structure on dislocation glide behavior in nanolaminates}, + publisher = {Springer Science and Business Media LLC}, + year = {2021}, + month = {jun}, + number = {13}, + volume = {36}, + pages = {2802--2815}, + url = {https://doi.org/10.1557\%2Fs43578-021-00261-y}, + doi = {10.1557/s43578-021-00261-y} +} + +@article{2021b, + author = {Fukumoto, K. -i. and Mabuchi, T. and Yabuuchi, K. and Fujii, K.}, + title = {Irradiation hardening of stainless steel model alloy after Fe-ion irradiation and post-irradiation annealing treatment}, + publisher = {Elsevier BV}, + year = {2021}, + month = {dec}, + volume = {557}, + pages = {153296}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2021.153296}, + doi = {10.1016/j.jnucmat.2021.153296} +} + @article{Abdolrahim_2014, author = {Abdolrahim, Niaz and Zbib, Hussein M. and Bahr, David F.}, title = {Multiscale modeling and simulation of deformation in nanoscale metallic multilayer systems}, @@ -7,7 +686,7 @@ month = {jan}, volume = {52}, pages = {33--50}, - url = {https://doi.org/10.1016%2Fj.ijplas.2013.04.002}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2013.04.002}, doi = {10.1016/j.ijplas.2013.04.002} } @@ -35,7 +714,7 @@ pages = {326--342}, url = {http://www.sciencedirect.com/science/article/pii/S1359645414000238}, doi = {10.1016/j.actamat.2014.01.014}, - abstract = {This work discusses coarse-grained micromechanics of tensile twinning in magnesium (Mg) extracted from molecular dynamics (MD) simulations. We perform MD simulations on Mg single crystal orientations with initial idealized defect structures at temperatures T=5K and 300K. A detailed atomistic analysis reveals that tensile loading along the c-axis of a defective crystal causes an initial incomplete slip ahead of the defect on the first-order pyramidal âØE©c+aâØEplanes, followed by the formation of a \{112̄1\} twin embryo and basal dislocation. These mechanisms aid the formation of \{101̄2\} twins, which evolve rapidly while \{112̄1\} twins disappear. We present a micromechanics picture of the deformation-induced twin structure evolution that is tracked by incorporating a twin orientation analysis (TOA) scheme within Open Visualization Tool. The functional dependencies of the volume fraction (v.f.) and number of twins on the overall plastic strain extracted from this analysis provide a basis to construct kinetic laws for twin evolution in terms of nucleation, growth and coalescence. Preliminary results indicate that \{101̄2\} v.f. evolution is dominated by twin growth in the presence of defects at room temperature, and it may not be strongly rate dependent. © 2014 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.}, + abstract = {This work discusses coarse-grained micromechanics of tensile twinning in magnesium (Mg) extracted from molecular dynamics (MD) simulations. We perform MD simulations on Mg single crystal orientations with initial idealized defect structures at temperatures T=5K and 300K. A detailed atomistic analysis reveals that tensile loading along the c-axis of a defective crystal causes an initial incomplete slip ahead of the defect on the first-order pyramidal âØE©c+aâØEplanes, followed by the formation of a \112̄1\ twin embryo and basal dislocation. These mechanisms aid the formation of \101̄2\ twins, which evolve rapidly while \112̄1\ twins disappear. We present a micromechanics picture of the deformation-induced twin structure evolution that is tracked by incorporating a twin orientation analysis (TOA) scheme within Open Visualization Tool. The functional dependencies of the volume fraction (v.f.) and number of twins on the overall plastic strain extracted from this analysis provide a basis to construct kinetic laws for twin evolution in terms of nucleation, growth and coalescence. Preliminary results indicate that \101̄2\ v.f. evolution is dominated by twin growth in the presence of defects at room temperature, and it may not be strongly rate dependent. © 2014 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.}, issn = {13596454}, keyword = {Continuum plasticity, Deformation twinning, Magnesium, MD simulations, Micromechanics} } @@ -50,13 +729,13 @@ number = {3}, volume = {102}, pages = {034314}, - url = {https://doi.org/10.1063%2F1.2757082}, + url = {https://doi.org/10.1063\%2F1.2757082}, doi = {10.1063/1.2757082} } @article{aluru_dynamic_1999, author = {Aluru, Srinivas and Sevilgen, Fatih E.}, - title = {Dynamic compressed hyperoctrees with application to the {N}-body problem}, + title = {Dynamic compressed hyperoctrees with application to the N-body problem}, journal = {Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)}, year = {1999}, volume = {1738}, @@ -66,16 +745,30 @@ issn = {16113349} } +@article{An_2019, + author = {An, M. R. and Song, H. Y. and Deng, Q. and Su, M. J. and Liu, Y. M.}, + title = {Influence of interface with mismatch dislocations on mechanical properties of Ti/Al nanolaminate}, + journal = {Journal of Applied Physics}, + publisher = {AIP Publishing}, + year = {2019}, + month = {apr}, + number = {16}, + volume = {125}, + pages = {165307}, + url = {https://doi.org/10.1063\%2F1.5085455}, + doi = {10.1063/1.5085455} +} + @article{Anciaux_2018, author = {Anciaux, G. and Junge, T. and Hodapp, M. and Cho, J. and Molinari, J. -F. and Curtin, W. A.}, - title = {The Coupled Atomistic/Discrete-Dislocation method in 3d part {I}: Concept and algorithms}, + title = {The Coupled Atomistic/Discrete-Dislocation method in 3d part I: Concept and algorithms}, journal = {Journal of the Mechanics and Physics of Solids}, publisher = {Elsevier BV}, year = {2018}, month = {sep}, volume = {118}, pages = {152--171}, - url = {https://doi.org/10.1016%2Fj.jmps.2018.05.004}, + url = {https://doi.org/10.1016\%2Fj.jmps.2018.05.004}, doi = {10.1016/j.jmps.2018.05.004} } @@ -98,7 +791,7 @@ @article{andric_new_2017, author = {Andric, Predrag and Curtin, W. A.}, - title = {New theory for {Mode} {I} crack-tip dislocation emission}, + title = {New theory for Mode I crack-tip dislocation emission}, journal = {Journal of the Mechanics and Physics of Solids}, year = {2017}, volume = {106}, @@ -120,22 +813,47 @@ month = {mar}, volume = {166}, pages = {658--676}, - url = {https://doi.org/10.1016%2Fj.actamat.2018.12.037}, + url = {https://doi.org/10.1016\%2Fj.actamat.2018.12.037}, doi = {10.1016/j.actamat.2018.12.037} } -@article{Anwar_Ali_2019a, - author = {Ali, Hashina Parveen Anwar and Radchenko, Ihor and Li, Nan and Budiman, Arief}, - title = {Effect of multilayer interface through in situ fracture of Cu/Nb and Al/Nb metallic multilayers}, - journal = {Journal of Materials Research}, - publisher = {Cambridge University Press (CUP)}, - year = {2019}, - month = {jan}, - number = {9}, - volume = {34}, - pages = {1564--1573}, - url = {https://doi.org/10.1557%2Fjmr.2018.449}, - doi = {10.1557/jmr.2018.449} +@article{Antillon_2020, + author = {Antillon, E. and Woodward, C. and Rao, S. I. and Akdim, B. and Parthasarathy, T. A.}, + title = {Chemical short range order strengthening in a model FCC high entropy alloy}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2020}, + month = {may}, + volume = {190}, + pages = {29--42}, + url = {https://doi.org/10.1016\%2Fj.actamat.2020.02.041}, + doi = {10.1016/j.actamat.2020.02.041} +} + +@article{Antillon_2020a, + author = {Antillon, Edwin and Ghazisaeidi, Maryam}, + title = {Efficient determination of solid-state phase equilibrium with the multicell Monte Carlo method}, + journal = {Physical Review E}, + publisher = {American Physical Society (APS)}, + year = {2020}, + month = {jun}, + number = {6}, + volume = {101}, + url = {https://doi.org/10.1103\%2Fphysreve.101.063306}, + doi = {10.1103/physreve.101.063306} +} + +@article{Antillon_2020b, + author = {Antillon, E. and Woodward, C. and Rao, S. I. and Akdim, B. and Parthasarathy, T. A.}, + title = {Chemical short range order strengthening in a model FCC high entropy alloy}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2020}, + month = {may}, + volume = {190}, + pages = {29--42}, + url = {https://doi.org/10.1016\%2Fj.actamat.2020.02.041}, + doi = {10.1016/j.actamat.2020.02.041} } @article{Anwar_Ali_2019, @@ -148,10 +866,24 @@ number = {9}, volume = {34}, pages = {1449--1468}, - url = {https://doi.org/10.1557%2Fjmr.2019.75}, + url = {https://doi.org/10.1557\%2Fjmr.2019.75}, doi = {10.1557/jmr.2019.75} } +@article{Anwar_Ali_2019a, + author = {Ali, Hashina Parveen Anwar and Radchenko, Ihor and Li, Nan and Budiman, Arief}, + title = {Effect of multilayer interface through in situ fracture of Cu/Nb and Al/Nb metallic multilayers}, + journal = {Journal of Materials Research}, + publisher = {Cambridge University Press (CUP)}, + year = {2019}, + month = {jan}, + number = {9}, + volume = {34}, + pages = {1564--1573}, + url = {https://doi.org/10.1557\%2Fjmr.2018.449}, + doi = {10.1557/jmr.2018.449} +} + @article{bachurin_dislocation-grain_2010, author = {Bachurin, D. V. and Weygand, D. and Gumbsch, P.}, title = {Dislocation-grain boundary interaction in 〈1 1 1〉 textured thin metal films}, @@ -171,14 +903,14 @@ @article{banerjee_influence_2001, author = {Banerjee, Rajarshi and Fain, Jason P. and Anderson, Peter M. and Fraser, Hamish L.}, - title = {Influence of crystallographic orientation and layer thickness on fracture behavior of {Ni}/{Ni3Al} multilayered thin films}, + title = {Influence of crystallographic orientation and layer thickness on fracture behavior of Ni/Ni3Al multilayered thin films}, journal = {Scripta Materialia}, year = {2001}, number = {11}, volume = {44}, pages = {2629--2633}, doi = {10.1016/S1359-6462(01)00966-6}, - abstract = {Ni/Ni3Al multilayers have been deposited epitaxially and non-epitaxially by UHV magnetron sputtering on 〈001〉 NaCl substrates. Two interfacial orientations were achieved: \{001\} Ni // \{001\} Ni3Al, 〈100〉 Ni // 〈100〉 Ni3Al and \{111\} Ni // \{111\} Ni3Al, 〈110〉 Ni // 〈110〉 Ni3Al. Under in-plane tensile loading, 〈001〉 oriented multilayers exhibit ductile fracture surface features but 〈111〉 oriented multilayers of the same layer thickness are predominantly brittle. For each orientation, the fracture surface features from 20 nm thick Ni and Ni3Al layers appear to be as ductile or more ductile than those from 120 nm thick layers, but the plastic deformation appears to be more localized. © 2001 Acta Materialia Inc.}, + abstract = {Ni/Ni3Al multilayers have been deposited epitaxially and non-epitaxially by UHV magnetron sputtering on 〈001〉 NaCl substrates. Two interfacial orientations were achieved: \001\ Ni // \001\ Ni3Al, 〈100〉 Ni // 〈100〉 Ni3Al and \111\ Ni // \111\ Ni3Al, 〈110〉 Ni // 〈110〉 Ni3Al. Under in-plane tensile loading, 〈001〉 oriented multilayers exhibit ductile fracture surface features but 〈111〉 oriented multilayers of the same layer thickness are predominantly brittle. For each orientation, the fracture surface features from 20 nm thick Ni and Ni3Al layers appear to be as ductile or more ductile than those from 120 nm thick layers, but the plastic deformation appears to be more localized. © 2001 Acta Materialia Inc.}, file = {/home/aselimov/docs/My Library/files/852/Influence of crystallographic orientation and layer thickness on fracture behavior of Ni-Ni3Al films.pdf}, issn = {13596462} } @@ -208,13 +940,13 @@ month = {may}, number = {18}, volume = {87}, - url = {https://doi.org/10.1103%2Fphysrevb.87.184115}, + url = {https://doi.org/10.1103\%2Fphysrevb.87.184115}, doi = {10.1103/physrevb.87.184115} } @article{baskes_modified_1994, author = {Baskes, M I and Johnson, R A}, - title = {Modified embedded atom potentials for {HCP} metals}, + title = {Modified embedded atom potentials for HCP metals}, journal = {Modelling and Simulation in Materials Science and Engineering}, year = {1994}, number = {1}, @@ -261,6 +993,20 @@ keyword = {COMPUTERIZED SIMULATION, LIQUIDS, MOLECULAR DYNAMICS CALCULATION, STRUCTURE FACTORS, TRANSPORT THEORY} } +@article{Bertin_2020, + author = {Bertin, Nicolas and Sills, Ryan B. and Cai, Wei}, + title = {Frontiers in the Simulation of Dislocations}, + journal = {Annual Review of Materials Research}, + publisher = {Annual Reviews}, + year = {2020}, + month = {jul}, + number = {1}, + volume = {50}, + pages = {437--464}, + url = {https://doi.org/10.1146\%2Fannurev-matsci-091819-015500}, + doi = {10.1146/annurev-matsci-091819-015500} +} + @article{beyerlein_defect-interface_2015, author = {Beyerlein, I. J. and Demkowicz, M. J. and Misra, A. and Uberuaga, B. P.}, title = {Defect-interface interactions}, @@ -286,7 +1032,7 @@ pages = {4386--4390}, url = {http://www.pnas.org/cgi/doi/10.1073/pnas.1319436111}, doi = {10.1073/pnas.1319436111}, - abstract = {Atomically ordered bimetal interfaces typically develop in near-equilibrium epitaxial growth (bottom-up processing) of nanolayered composite films and have been considered responsible for a number of intriguing material properties. Here, we discover that interfaces of such atomic level order can also emerge ubiquitously in large-scale layered nanocomposites fabricated by extreme strain (top down) processing. This is a counterintuitive result, which we propose occurs because extreme plastic straining creates new interfaces separated by single crystal layers of nanometer thickness. On this basis, with atomic-scale modeling and crystal plasticity theory, we prove that the preferred bimetal interface arising from extreme strains corresponds to a unique stable state, which can be predicted by two controlling stability conditions. As another testament to its stability, we provide experimental evidence showing that this interface maintains its integrity in further straining (strains {\textbackslash}textgreater 12), elevated temperatures ({\textbackslash}textgreater 0.45 Tm of a constituent), and irradiation (light ion). These results open a new frontier in the fabrication of stable nanomaterials with severe plastic deformation techniques.}, + abstract = {Atomically ordered bimetal interfaces typically develop in near-equilibrium epitaxial growth (bottom-up processing) of nanolayered composite films and have been considered responsible for a number of intriguing material properties. Here, we discover that interfaces of such atomic level order can also emerge ubiquitously in large-scale layered nanocomposites fabricated by extreme strain (top down) processing. This is a counterintuitive result, which we propose occurs because extreme plastic straining creates new interfaces separated by single crystal layers of nanometer thickness. On this basis, with atomic-scale modeling and crystal plasticity theory, we prove that the preferred bimetal interface arising from extreme strains corresponds to a unique stable state, which can be predicted by two controlling stability conditions. As another testament to its stability, we provide experimental evidence showing that this interface maintains its integrity in further straining (strains \textgreater 12), elevated temperatures (\textgreater 0.45 Tm of a constituent), and irradiation (light ion). These results open a new frontier in the fabrication of stable nanomaterials with severe plastic deformation techniques.}, file = {/home/aselimov/docs/My Library/files/877/Emergence of stable interfaces under extreme plastic deformation.pdf}, issn = {0027-8424}, pmid = {24616514} @@ -309,116 +1055,6 @@ keyword = {Nanoindentation, Nanoscale, Transmission electron microscopy (TEM)} } -\relax -\bibstyle{IEEEtran} -\citation{*} -\bibdata{Xiang_2018} -This is BibTeX, Version 0.99d (TeX Live 2020/Arch Linux) -Capacity: max_strings=100000, hash_size=100000, hash_prime=85009 -The top-level auxiliary file: bib2html19b8ac.aux -I couldn't open style file IEEEtran.bst ----line 2 of file bib2html19b8ac.aux - : \bibstyle{IEEEtran - : } -I'm skipping whatever remains of this command -I found no style file---while reading file bib2html19b8ac.aux -You've used 0 entries, - 0 wiz_defined-function locations, - 85 strings with 520 characters, -and the built_in function-call counts, 0 in all, are: -= -- 0 -> -- 0 -< -- 0 -+ -- 0 -- -- 0 -* -- 0 -:= -- 0 -add.period$ -- 0 -call.type$ -- 0 -change.case$ -- 0 -chr.to.int$ -- 0 -cite$ -- 0 -duplicate$ -- 0 -empty$ -- 0 -format.name$ -- 0 -if$ -- 0 -int.to.chr$ -- 0 -int.to.str$ -- 0 -missing$ -- 0 -newline$ -- 0 -num.names$ -- 0 -pop$ -- 0 -preamble$ -- 0 -purify$ -- 0 -quote$ -- 0 -skip$ -- 0 -stack$ -- 0 -substring$ -- 0 -swap$ -- 0 -text.length$ -- 0 -text.prefix$ -- 0 -top$ -- 0 -type$ -- 0 -warning$ -- 0 -while$ -- 0 -width$ -- 0 -write$ -- 0 -(There were 2 error messages) -\relax -\bibstyle{IEEEtran} -\citation{*} -\bibdata{Xiang_2018} -This is BibTeX, Version 0.99d (TeX Live 2020/Arch Linux) -Capacity: max_strings=100000, hash_size=100000, hash_prime=85009 -The top-level auxiliary file: bib2html54056f.aux -I couldn't open style file IEEEtran.bst ----line 2 of file bib2html54056f.aux - : \bibstyle{IEEEtran - : } -I'm skipping whatever remains of this command -I found no style file---while reading file bib2html54056f.aux -You've used 0 entries, - 0 wiz_defined-function locations, - 85 strings with 520 characters, -and the built_in function-call counts, 0 in all, are: -= -- 0 -> -- 0 -< -- 0 -+ -- 0 -- -- 0 -* -- 0 -:= -- 0 -add.period$ -- 0 -call.type$ -- 0 -change.case$ -- 0 -chr.to.int$ -- 0 -cite$ -- 0 -duplicate$ -- 0 -empty$ -- 0 -format.name$ -- 0 -if$ -- 0 -int.to.chr$ -- 0 -int.to.str$ -- 0 -missing$ -- 0 -newline$ -- 0 -num.names$ -- 0 -pop$ -- 0 -preamble$ -- 0 -purify$ -- 0 -quote$ -- 0 -skip$ -- 0 -stack$ -- 0 -substring$ -- 0 -swap$ -- 0 -text.length$ -- 0 -text.prefix$ -- 0 -top$ -- 0 -type$ -- 0 -warning$ -- 0 -while$ -- 0 -width$ -- 0 -write$ -- 0 -(There were 2 error messages) @article{Bitzek_2004, author = {Bitzek, Erik and Gumbsch, Peter}, title = {Atomistic study of drag, surface and inertial effects on edge dislocations in face-centered cubic metals}, @@ -428,7 +1064,7 @@ write$ -- 0 month = {dec}, volume = {387-389}, pages = {11--15}, - url = {https://doi.org/10.1016%2Fj.msea.2004.01.092}, + url = {https://doi.org/10.1016\%2Fj.msea.2004.01.092}, doi = {10.1016/j.msea.2004.01.092} } @@ -441,13 +1077,13 @@ write$ -- 0 month = {oct}, number = {17}, volume = {97}, - url = {https://doi.org/10.1103%2Fphysrevlett.97.170201}, + url = {https://doi.org/10.1103\%2Fphysrevlett.97.170201}, doi = {10.1103/physrevlett.97.170201} } @article{bitzek_atomistic_2008, author = {BITZEK, Erik and GUMBSCH, Peter}, - title = {Atomistic {Simulations} of {Dislocation} - {Crack} {Interaction}}, + title = {Atomistic Simulations of Dislocation - Crack Interaction}, journal = {Journal of Solid Mechanics and Materials Engineering}, year = {2008}, number = {10}, @@ -493,7 +1129,7 @@ write$ -- 0 @article{bitzek_structural_2006, author = {Bitzek, Erik and Koskinen, Pekka and Gähler, Franz and Moseler, Michael and Gumbsch, Peter}, - title = {Structural {Relaxation} {Made} {Simple}}, + title = {Structural Relaxation Made Simple}, journal = {Physical Review Letters}, year = {2006}, month = {October}, @@ -506,6 +1142,20 @@ write$ -- 0 issn = {0031-9007} } +@article{Blanc_2010, + author = {Blanc, X. and Le~Bris, C. and Legoll, F. and Patz, C.}, + title = {Finite-Temperature Coarse-Graining of~One-Dimensional Models: Mathematical Analysis and~Computational Approaches}, + journal = {Journal of Nonlinear Science}, + publisher = {Springer Science and Business Media LLC}, + year = {2010}, + month = {feb}, + number = {2}, + volume = {20}, + pages = {241--275}, + url = {https://doi.org/10.1007\%2Fs00332-009-9057-y}, + doi = {10.1007/s00332-009-9057-y} +} + @article{bollmann_basic_1972, author = {Bollmann, W.}, title = {The basic concepts of the 0-lattice theory}, @@ -520,9 +1170,37 @@ write$ -- 0 issn = {00396028} } +@article{Bonny_2011, + author = {Bonny, G. and Pasianot, R. C. and Terentyev, D. and Malerba, L.}, + title = {Iron chromium potential to model high-chromium ferritic alloys}, + journal = {Philosophical Magazine}, + publisher = {Informa UK Limited}, + year = {2011}, + month = {apr}, + number = {12}, + volume = {91}, + pages = {1724--1746}, + url = {https://doi.org/10.1080\%2F14786435.2010.545780}, + doi = {10.1080/14786435.2010.545780} +} + +@article{Bonny_2011a, + author = {Bonny, G and Terentyev, D and Pasianot, R C and Poncé, S and Bakaev, A}, + title = {Interatomic potential to study plasticity in stainless steels: the FeNiCr model alloy}, + journal = {Modelling and Simulation in Materials Science and Engineering}, + publisher = {IOP Publishing}, + year = {2011}, + month = {nov}, + number = {8}, + volume = {19}, + pages = {085008}, + url = {https://doi.org/10.1088\%2F0965-0393\%2F19\%2F8\%2F085008}, + doi = {10.1088/0965-0393/19/8/085008} +} + @article{britton_mechanistic_2015, author = {Britton, TB and Dunne, FPE and Wilkinson, AJ}, - title = {On the mechanistic basis of deformation at the microscale in hexagonal close-packed metals {On} the mechanistic basis of deformation at the microscale in hexagonal close-packed metals}, + title = {On the mechanistic basis of deformation at the microscale in hexagonal close-packed metals On the mechanistic basis of deformation at the microscale in hexagonal close-packed metals}, journal = {Proc. R. Soc. A}, year = {2015}, volume = {471}, @@ -533,6 +1211,19 @@ write$ -- 0 keyword = {energy, HCP, HCP slip, materials science, mechanical engineering, Slip} } +@article{Bryukhanov_2020, + author = {Bryukhanov, I. A.}, + title = {Dynamics of edge dislocation in Cu–Ni solid solution alloys at atomic scale}, + journal = {International Journal of Plasticity}, + publisher = {Elsevier BV}, + year = {2020}, + month = {dec}, + volume = {135}, + pages = {102834}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2020.102834}, + doi = {10.1016/j.ijplas.2020.102834} +} + @article{budarapu_adaptive_2014, author = {Budarapu, Pattabhi R. and Gracie, Robert and Bordas, Stéphane P.A. and Rabczuk, Timon}, title = {An adaptive multiscale method for quasi-static crack growth}, @@ -558,10 +1249,23 @@ write$ -- 0 number = {1}, volume = {126}, pages = {014101}, - url = {https://doi.org/10.1063%2F1.2408420}, + url = {https://doi.org/10.1063\%2F1.2408420}, doi = {10.1063/1.2408420} } +@article{Cao_2019, + author = {Cao, Z. H. and Cai, Y. P. and Sun, C. and Ma, Y. J. and Wei, M. Z. and Li, Q. and Lu, H. M. and Wang, H. and Zhang, X. and Meng, X. K.}, + title = {Tailoring strength and plasticity of Ag/Nb nanolaminates via intrinsic microstructure and extrinsic dimension}, + journal = {International Journal of Plasticity}, + publisher = {Elsevier BV}, + year = {2019}, + month = {feb}, + volume = {113}, + pages = {145--157}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2018.09.012}, + doi = {10.1016/j.ijplas.2018.09.012} +} + @article{caputo_evaluation_2013, author = {Caputo, Francesco and Lamanna, Giuseppe and Soprano, Alessandro}, title = {On the evaluation of the plastic zone size at the crack tip}, @@ -579,7 +1283,7 @@ write$ -- 0 @article{carlton_what_2007, author = {Carlton, C. E. and Ferreira, P. J.}, - title = {What is behind the inverse {Hall}-{Petch} effect in nanocrystalline materials?}, + title = {What is behind the inverse Hall-Petch effect in nanocrystalline materials?}, journal = {Acta Materialia}, year = {2007}, number = {11}, @@ -602,10 +1306,23 @@ write$ -- 0 number = {6-7}, volume = {60}, pages = {2625--2636}, - url = {https://doi.org/10.1016%2Fj.actamat.2012.01.029}, + url = {https://doi.org/10.1016\%2Fj.actamat.2012.01.029}, doi = {10.1016/j.actamat.2012.01.029} } +@article{Chavoshi_2016, + author = {Chavoshi, Saeed Zare and Xu, Shuozhi and Luo, Xichun}, + title = {Dislocation-mediated plasticity in silicon during nanometric cutting: A molecular dynamics simulation study}, + journal = {Materials Science in Semiconductor Processing}, + publisher = {Elsevier BV}, + year = {2016}, + month = {aug}, + volume = {51}, + pages = {60--70}, + url = {https://doi.org/10.1016\%2Fj.mssp.2016.05.003}, + doi = {10.1016/j.mssp.2016.05.003} +} + @article{Chavoshi_2019, author = {Chavoshi, Saeed Zare and Xu, Shuozhi}, title = {Nanoindentation/scratching at finite temperatures: Insights from atomistic-based modeling}, @@ -615,7 +1332,7 @@ write$ -- 0 month = {feb}, volume = {100}, pages = {1--20}, - url = {https://doi.org/10.1016%2Fj.pmatsci.2018.09.002}, + url = {https://doi.org/10.1016\%2Fj.pmatsci.2018.09.002}, doi = {10.1016/j.pmatsci.2018.09.002} } @@ -629,10 +1346,23 @@ write$ -- 0 number = {8}, volume = {41}, pages = {2085--2097}, - url = {https://doi.org/10.1016%2Fj.ijsolstr.2003.11.030}, + url = {https://doi.org/10.1016\%2Fj.ijsolstr.2003.11.030}, doi = {10.1016/j.ijsolstr.2003.11.030} } +@article{Chen_2018, + author = {Chen, X. Y. and Kong, X. F. and Misra, A. and Legut, D. and Yao, B. N. and Germann, T. C. and Zhang, R. F.}, + title = {Effect of dynamic evolution of misfit dislocation pattern on dislocation nucleation and shear sliding at semi-coherent bimetal interfaces}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2018}, + month = {jan}, + volume = {143}, + pages = {107--120}, + url = {https://doi.org/10.1016\%2Fj.actamat.2017.10.012}, + doi = {10.1016/j.actamat.2017.10.012} +} + @article{Chen_2018a, author = {Chen, Hao and Xu, Shuozhi and Li, Weixuan and Ji, Rigelesaiyin and Phan, Thanh and Xiong, Liming}, title = {A spatial decomposition parallel algorithm for a concurrent atomistic-continuum simulator and its preliminary applications}, @@ -642,21 +1372,21 @@ write$ -- 0 month = {mar}, volume = {144}, pages = {1--10}, - url = {https://doi.org/10.1016%2Fj.commatsci.2017.11.051}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2017.11.051}, doi = {10.1016/j.commatsci.2017.11.051} } -@article{Chen_2018, - author = {Chen, X. Y. and Kong, X. F. and Misra, A. and Legut, D. and Yao, B. N. and Germann, T. C. and Zhang, R. F.}, - title = {Effect of dynamic evolution of misfit dislocation pattern on dislocation nucleation and shear sliding at semi-coherent bimetal interfaces}, - journal = {Acta Materialia}, - publisher = {Elsevier BV}, +@article{Chen_2018b, + author = {Chen, Youping and Diaz, Adrian}, + title = {Physical foundation and consistent formulation of atomic-level fluxes in transport processes}, + journal = {Physical Review E}, + publisher = {American Physical Society (APS)}, year = {2018}, - month = {jan}, - volume = {143}, - pages = {107--120}, - url = {https://doi.org/10.1016%2Fj.actamat.2017.10.012}, - doi = {10.1016/j.actamat.2017.10.012} + month = {nov}, + number = {5}, + volume = {98}, + url = {https://doi.org/10.1103\%2Fphysreve.98.052113}, + doi = {10.1103/physreve.98.052113} } @article{Chen_2019, @@ -669,10 +1399,23 @@ write$ -- 0 number = {10}, volume = {126}, pages = {101101}, - url = {https://doi.org/10.1063%2F1.5099653}, + url = {https://doi.org/10.1063\%2F1.5099653}, doi = {10.1063/1.5099653} } +@article{Chen_2019a, + author = {Chen, Dengke and Costello, Luke L. and Geller, Clint B. and Zhu, Ting and McDowell, David L.}, + title = {Atomistic modeling of dislocation cross-slip in nickel using free-end nudged elastic band method}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2019}, + month = {apr}, + volume = {168}, + pages = {436--447}, + url = {https://doi.org/10.1016\%2Fj.actamat.2019.02.035}, + doi = {10.1016/j.actamat.2019.02.035} +} + @article{Chen_2020, author = {Chen, Y. and Li, N. and Hoagland, R. G. and Liu, X. -Y. and Baldwin, J. K. and Beyerlein, I. J. and Cheng, J. Y. and Mara, N. A.}, title = {Effects of three-dimensional Cu/Nb interfaces on strengthening and shear banding in nanoscale metallic multilayers}, @@ -680,7 +1423,7 @@ write$ -- 0 publisher = {Elsevier BV}, year = {2020}, month = {aug}, - url = {https://doi.org/10.1016%2Fj.actamat.2020.08.019}, + url = {https://doi.org/10.1016\%2Fj.actamat.2020.08.019}, doi = {10.1016/j.actamat.2020.08.019} } @@ -744,7 +1487,7 @@ write$ -- 0 @article{cho_toward_2015, author = {Cho, Jaehyun and Junge, Till and Molinari, Jean-françois and Anciaux, Guillaume}, - title = {Toward a {3D} coupled atomistic and discrete dislocation dynamics simulation : dislocation core structures and {Peierls} stresses with several character angles in {FCC} aluminum}, + title = {Toward a 3D coupled atomistic and discrete dislocation dynamics simulation : dislocation core structures and Peierls stresses with several character angles in FCC aluminum}, journal = {Advanced Modeling and Simulation in Engineering Sciences}, year = {2015}, number = {12}, @@ -753,12 +1496,43 @@ write$ -- 0 doi = {10.1186/s40323-015-0028-6}, file = {/home/aselimov/docs/My Library/files/874/Cho et al. - 2015 - Toward a 3D coupled atomistic and discrete dislocation dynamics simulation dislocation core structures and Peierls s.pdf}, issn = {2213-7467}, - keyword = {\#x2010, \#x26, cadd3d, CADD3D, character angle, Character angle, mixed dislocation, Mixed dislocation, Nabarro method, peierls stress, Peierls stress, peierls-nabarro method, shockley partial, Shockley partial, variational, Variational Peierls\&\#x26} + keyword = {#x2010, #x26, cadd3d, CADD3D, character angle, Character angle, mixed dislocation, Mixed dislocation, Nabarro method, peierls stress, Peierls stress, peierls-nabarro method, shockley partial, Shockley partial, variational, Variational Peierls\&} +} + +@article{chu2020temperature, + author = {Chu, Kevin and Foster, Michael E and Sills, Ryan B and Zhou, Xiaowang and Zhu, Ting and McDowell, David L}, + title = {Temperature and composition dependent screw dislocation mobility in austenitic stainless steels from large-scale molecular dynamics}, + journal = {npj Computational Materials}, + publisher = {Nature Publishing Group}, + year = {2020}, + number = {1}, + volume = {6}, + pages = {1--10} +} + +@article{chu2021, + author = {Chu, K. and Diaz, A. and Chen, Y. and Zhu, T. and McDowell, D.L.}, + title = {Multiscale Conurrent Atomistic-Continuum (CAC) modeling of multicomponent alloys}, + journal = {Prep}, + year = {2021} +} + +@article{Chu_2022, + author = {Chu, Kevin and Diaz, Adrian and Chen, Youping and Zhu, Ting and McDowell, David L.}, + title = {Multiscale Concurrent Atomistic-Continuum (CAC) modeling of multicomponent alloys}, + journal = {Computational Materials Science}, + publisher = {Elsevier BV}, + year = {2022}, + month = {jan}, + volume = {201}, + pages = {110873}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2021.110873}, + doi = {10.1016/j.commatsci.2021.110873} } @article{clemens_structure_1999, author = {Clemens, B.M. and Kung, H. and Barnett, S.A.}, - title = {Structure and {Strength} of {Multilayers}}, + title = {Structure and Strength of Multilayers}, journal = {MRS Bulletin}, year = {1999}, month = {February}, @@ -767,27 +1541,40 @@ write$ -- 0 pages = {20--26}, url = {http://www.journals.cambridge.org/abstract_S0883769400051502}, doi = {10.1557/S0883769400051502}, - abstract = {{\textbackslash}textlessp{\textbackslash}textgreater Nanometer-scale multilayer materials exhibit a wealth of interesting structural and mechanical property behaviors. Physical-vapor-deposition technology allows almost unlimited freedom to choose among elements, alloys, and Compounds as layering constituents and to design and produce materials with compositional and structural periodicities approaching the atomic Scale. These materials have tremendous interface area density, approaching 10 {\textbackslash}textlesssup{\textbackslash}textgreater6{\textbackslash}textless/sup{\textbackslash}textgreater mm/mm {\textbackslash}textlesssup{\textbackslash}textgreater3{\textbackslash}textless/sup{\textbackslash}textgreater , so that a Square centimeter area of a one-micron-thick multilayer film with a bilayer period of 2 nm has an interface area of roughly 1,000 cm {\textbackslash}textlesssup{\textbackslash}textgreater2{\textbackslash}textless/sup{\textbackslash}textgreater . Hence interfacial effects can dominate multilayer structure and properties leading to unusually large strains and frequently stabilization of metastable structures. The atomic-scale layering of different materials also leads to very high hardnesses and good wear resistance. These materials are a test-bed for examination of the fundamental aspects of phase stability and for exploring mechanical strengthening mechanisms. They are also becoming increasingly interesting for applications such as hard coatings, x-ray optical elements, in microelectromechanical Systems (MEMS), and in magnetic recording media and heads. {\textbackslash}textless/p{\textbackslash}textgreater}, + abstract = {\textlessp\textgreater Nanometer-scale multilayer materials exhibit a wealth of interesting structural and mechanical property behaviors. Physical-vapor-deposition technology allows almost unlimited freedom to choose among elements, alloys, and Compounds as layering constituents and to design and produce materials with compositional and structural periodicities approaching the atomic Scale. These materials have tremendous interface area density, approaching 10 \textlesssup\textgreater6\textless/sup\textgreater mm/mm \textlesssup\textgreater3\textless/sup\textgreater , so that a Square centimeter area of a one-micron-thick multilayer film with a bilayer period of 2 nm has an interface area of roughly 1,000 cm \textlesssup\textgreater2\textless/sup\textgreater . Hence interfacial effects can dominate multilayer structure and properties leading to unusually large strains and frequently stabilization of metastable structures. The atomic-scale layering of different materials also leads to very high hardnesses and good wear resistance. These materials are a test-bed for examination of the fundamental aspects of phase stability and for exploring mechanical strengthening mechanisms. They are also becoming increasingly interesting for applications such as hard coatings, x-ray optical elements, in microelectromechanical Systems (MEMS), and in magnetic recording media and heads. \textless/p\textgreater}, file = {/home/aselimov/docs/My Library/files/840/Clemens, Kung, Barnett - 1999 - Structure and Strength of Multilayers.pdf}, issn = {0883-7694} } +@article{Cohen_1999, + author = {Cohen, T. and Yahalom, J. and Kaplan, W. D.}, + title = {Electrodeposition of Metallic Multilayers by a Pulse Method}, + journal = {Reviews in Analytical Chemistry}, + publisher = {Walter de Gruyter GmbH}, + year = {1999}, + month = {jan}, + number = {5}, + volume = {18}, + url = {https://doi.org/10.1515\%2Frevac.1999.18.5.279}, + doi = {10.1515/revac.1999.18.5.279} +} + @article{Couret_1993, author = {Couret, A. and Crestou, J. and Farenc, S. and Molenat, G. and Clement, N. and Coujou, A. and Caillard, D.}, - title = {In situ deformation in {T}.{E}.{M}.: recent developments}, + title = {In situ deformation in T.E.M.: recent developments}, journal = {Microscopy Microanalysis Microstructures}, publisher = {EDP Sciences}, year = {1993}, number = {2-3}, volume = {4}, pages = {153--170}, - url = {https://doi.org/10.1051%2Fmmm%3A0199300402-3015300}, + url = {https://doi.org/10.1051\%2Fmmm\%3A0199300402-3015300}, doi = {10.1051/mmm:0199300402-3015300} } @book{cui_investigation_2017, author = {Cui, Yinan}, - title = {The {Investigation} of {Plastic} {Behavior} by {Discrete} {Dislocation} {Dynamics} for {Single} {Crystal} {Pillar} at {Submicron} {Scale}}, + title = {The Investigation of Plastic Behavior by Discrete Dislocation Dynamics for Single Crystal Pillar at Submicron Scale}, year = {2017}, number = {9}, volume = {53}, @@ -810,10 +1597,24 @@ write$ -- 0 number = {8}, volume = {53}, pages = {5604--5617}, - url = {https://doi.org/10.1007%2Fs10853-017-1704-3}, + url = {https://doi.org/10.1007\%2Fs10853-017-1704-3}, doi = {10.1007/s10853-017-1704-3} } +@article{Dang_2018, + author = {Dang, Khanh and Spearot, Douglas}, + title = {Pressure Dependence of the Peierls Stress in Aluminum}, + journal = {JOM}, + publisher = {Springer Science and Business Media LLC}, + year = {2018}, + month = {mar}, + number = {7}, + volume = {70}, + pages = {1094--1099}, + url = {https://doi.org/10.1007\%2Fs11837-018-2819-y}, + doi = {10.1007/s11837-018-2819-y} +} + @article{Daw_1984, author = {Daw, Murray S. and Baskes, M. I.}, title = {Embedded-atom method: Derivation and application to impurities, surfaces, and other defects in metals}, @@ -824,13 +1625,13 @@ write$ -- 0 number = {12}, volume = {29}, pages = {6443--6453}, - url = {https://doi.org/10.1103%2Fphysrevb.29.6443}, + url = {https://doi.org/10.1103\%2Fphysrevb.29.6443}, doi = {10.1103/physrevb.29.6443} } @article{daw_embedded-atom_1984, author = {Daw, Murray S. and Baskes, M. I.}, - title = {Embedded-atom method: {Derivation} and application to impurities, surfaces, and other defects in metals}, + title = {Embedded-atom method: Derivation and application to impurities, surfaces, and other defects in metals}, journal = {Physical Review B}, year = {1984}, number = {12}, @@ -845,7 +1646,7 @@ write$ -- 0 @article{dehm_overview_2018, author = {Dehm, G. and Jaya, B. N. and Raghavan, R. and Kirchlechner, C.}, - title = {Overview on micro- and nanomechanical testing: {New} insights in interface plasticity and fracture at small length scales}, + title = {Overview on micro- and nanomechanical testing: New insights in interface plasticity and fracture at small length scales}, journal = {Acta Materialia}, year = {2018}, volume = {142}, @@ -869,13 +1670,26 @@ write$ -- 0 number = {20}, volume = {59}, pages = {7744--7756}, - url = {https://doi.org/10.1016%2Fj.actamat.2011.09.004}, + url = {https://doi.org/10.1016\%2Fj.actamat.2011.09.004}, doi = {10.1016/j.actamat.2011.09.004} } +@article{Demkowicz_2020, + author = {Demkowicz, Michael J.}, + title = {A threshold density of helium bubbles induces a ductile-to-brittle transition at a grain boundary in nickel}, + journal = {Journal of Nuclear Materials}, + publisher = {Elsevier BV}, + year = {2020}, + month = {may}, + volume = {533}, + pages = {152118}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2020.152118}, + doi = {10.1016/j.jnucmat.2020.152118} +} + @article{deng_coarse-grained_2013, author = {Deng, Qian and Chen, Youping}, - title = {A {Coarse}-grained atomistic method for {3D} dynamic fracture simulation}, + title = {A Coarse-grained atomistic method for 3D dynamic fracture simulation}, journal = {International Journal for Multiscale Computational Engineering}, year = {2013}, number = {3}, @@ -898,13 +1712,13 @@ write$ -- 0 number = {3}, volume = {14}, pages = {497--514}, - url = {https://doi.org/10.1088%2F0965-0393%2F14%2F3%2F011}, + url = {https://doi.org/10.1088\%2F0965-0393\%2F14\%2F3\%2F011}, doi = {10.1088/0965-0393/14/3/011} } @article{diard_evaluation_2005, author = {Diard, O. and Leclercq, S. and Rousselier, G. and Cailletaud, G.}, - title = {Evaluation of finite element based analysis of {3D} multicrystalline aggregates plasticity {Application} to crystal plasticity model identification and the study of stress and strain fields near grain boundaries}, + title = {Evaluation of finite element based analysis of 3D multicrystalline aggregates plasticity Application to crystal plasticity model identification and the study of stress and strain fields near grain boundaries}, journal = {International Journal of Plasticity}, year = {2005}, number = {4}, @@ -917,6 +1731,17 @@ write$ -- 0 keyword = {Grain boundaries, Crystal plasticity, Finite element, HCP materials, Heterogeneities} } +@incollection{Diaz_2018, + author = {Diaz, Adrian and McDowell, David and Chen, Youping}, + title = {The Limitations and Successes of Concurrent Dynamic Multiscale Modeling Methods at the Mesoscale}, + publisher = {Springer International Publishing}, + year = {2018}, + pages = {55--77}, + url = {https://doi.org/10.1007\%2F978-3-319-77504-3_3}, + doi = {10.1007/978-3-319-77504-3_3}, + booktitle = {Advanced Structured Materials} +} + @unpublished{dikken:hal-01572509, author = {Dikken, R and Khajeh Salehani, Mohsen}, title = {Edge dislocation impingement on interfaces between dissimilar metals}, @@ -930,9 +1755,22 @@ write$ -- 0 pdf = {https://hal.archives-ouvertes.fr/hal-01572509/file/impingAlNi.pdf} } +@article{Ding_2019, + author = {Ding, Yuqing and Pencer, Jeremy and Torres, Edmanuel}, + title = {Atomistic simulation study of the helium effects on the deformation behavior in nickel bicrystals}, + journal = {Journal of Nuclear Materials}, + publisher = {Elsevier BV}, + year = {2019}, + month = {apr}, + volume = {516}, + pages = {247--254}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2019.01.018}, + doi = {10.1016/j.jnucmat.2019.01.018} +} + @article{ding_modeling_2015, author = {Ding, Zhigang and Li, Shuang and Liu, Wei and Zhao, Yonghao}, - title = {Modeling of {Stacking} {Fault} {Energy} in {Hexagonal}-{Close}-{Packed} {Metals}}, + title = {Modeling of Stacking Fault Energy in Hexagonal-Close-Packed Metals}, journal = {Advances in Materials Science and Engineering}, year = {2015}, number = {May}, @@ -953,7 +1791,7 @@ write$ -- 0 month = {jun}, volume = {315}, pages = {211--220}, - url = {https://doi.org/10.1016%2Fj.jcp.2016.03.056}, + url = {https://doi.org/10.1016\%2Fj.jcp.2016.03.056}, doi = {10.1016/j.jcp.2016.03.056} } @@ -966,10 +1804,18 @@ write$ -- 0 month = {jun}, volume = {171}, pages = {92--107}, - url = {https://doi.org/10.1016%2Fj.actamat.2019.04.016}, + url = {https://doi.org/10.1016\%2Fj.actamat.2019.04.016}, doi = {10.1016/j.actamat.2019.04.016} } +@book{dove1993introduction, + author = {Dove, Martin T and Dove, Martin T}, + title = {Introduction to lattice dynamics}, + publisher = {Cambridge university press}, + year = {1993}, + number = {4} +} + @article{Dupraz_2019, author = {Dupraz, Maxime and Rao, Satish I. and Swygenhoven, Helena Van}, title = {Large scale 3-dimensional atomistic simulations of screw dislocations interacting with coherent twin boundaries in Al, Cu and Ni under uniaxial and multiaxial loading conditions}, @@ -979,10 +1825,23 @@ write$ -- 0 month = {aug}, volume = {174}, pages = {16--28}, - url = {https://doi.org/10.1016%2Fj.actamat.2019.05.025}, + url = {https://doi.org/10.1016\%2Fj.actamat.2019.05.025}, doi = {10.1016/j.actamat.2019.05.025} } +@article{Erel_2017, + author = {Erel, Can and Po, Giacomo and Crosby, Tamer and Ghoniem, Nasr}, + title = {Generation and interaction mechanisms of prismatic dislocation loops in FCC metals}, + journal = {Computational Materials Science}, + publisher = {Elsevier BV}, + year = {2017}, + month = {dec}, + volume = {140}, + pages = {32--46}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2017.07.043}, + doi = {10.1016/j.commatsci.2017.07.043} +} + @article{Erel_2017a, author = {Erel, C. and Po, G. and Ghoniem, N.}, title = {Dependence of hardening and saturation stress in persistent slip bands on strain amplitude during cyclic fatigue loading}, @@ -993,23 +1852,10 @@ write$ -- 0 number = {32}, volume = {97}, pages = {2947--2970}, - url = {https://doi.org/10.1080%2F14786435.2017.1361555}, + url = {https://doi.org/10.1080\%2F14786435.2017.1361555}, doi = {10.1080/14786435.2017.1361555} } -@article{Erel_2017, - author = {Erel, Can and Po, Giacomo and Crosby, Tamer and Ghoniem, Nasr}, - title = {Generation and interaction mechanisms of prismatic dislocation loops in FCC metals}, - journal = {Computational Materials Science}, - publisher = {Elsevier BV}, - year = {2017}, - month = {dec}, - volume = {140}, - pages = {32--46}, - url = {https://doi.org/10.1016%2Fj.commatsci.2017.07.043}, - doi = {10.1016/j.commatsci.2017.07.043} -} - @book{eringen1999microcontinuum, author = {Eringen, A}, title = {Microcontinuum Field Theories : I. Foundations and Solids}, @@ -1021,7 +1867,7 @@ write$ -- 0 @article{eslami_study_2013, author = {Eslami, A H and Zebarjad, S Mojtaba and Moshksar, M M}, - title = {Study on mechanical and magnetic properties of {Cu}/{Ni} multilayer composite fabricated by accumulative roll bonding process}, + title = {Study on mechanical and magnetic properties of Cu/Ni multilayer composite fabricated by accumulative roll bonding process}, journal = {Materials Science and Technology}, year = {2013}, month = {August}, @@ -1046,7 +1892,7 @@ write$ -- 0 number = {8}, volume = {83}, pages = {4069--4074}, - url = {https://doi.org/10.1063%2F1.449071}, + url = {https://doi.org/10.1063\%2F1.449071}, doi = {10.1063/1.449071} } @@ -1060,13 +1906,13 @@ write$ -- 0 number = {2}, volume = {2}, pages = {279--286}, - url = {https://doi.org/10.1016%2F0927-0256%2894%2990109-0}, + url = {https://doi.org/10.1016\%2F0927-0256\%2894\%2990109-0}, doi = {10.1016/0927-0256(94)90109-0} } @article{fan_simulation_2017, author = {Fan, Jinghong and Stewart, Ross and Xu, Taolong}, - title = {Simulation accuracy of crack-tip parameters with extended {GP} methods}, + title = {Simulation accuracy of crack-tip parameters with extended GP methods}, journal = {Engineering Fracture Mechanics}, year = {2017}, volume = {170}, @@ -1079,9 +1925,18 @@ write$ -- 0 keyword = {Asymptotic analysis, BCC-Fe, Model size effects, Simulation accuracy, TS curve} } +@article{farkas2021deformation, + author = {Farkas, Diana}, + title = {Deformation behavior of a model high entropy alloy from atomistic simulations}, + journal = {Materials Science and Engineering: A}, + publisher = {Elsevier}, + year = {2021}, + pages = {141124} +} + @article{farkas_interatomic_1994, author = {Farkas, Diana}, - title = {Interatomic potentials for {Ti}-{Al} with and without angular forces}, + title = {Interatomic potentials for Ti-Al with and without angular forces}, journal = {Modelling and Simulation in Materials Science and Engineering}, year = {1994}, volume = {2}, @@ -1091,14 +1946,14 @@ write$ -- 0 @article{farkas_modelling_1994, author = {Farkas, Diana and Jones, Chris}, - title = {Modelling and {Simulation} in {Materials} {Science} and {Engineering} {Related} content {Interatomic} potentials for {Ti}-{Al} with and without angular forces {Interatomic} potentials for {Ti}-{AI} with and without angular forces}, + title = {Modelling and Simulation in Materials Science and Engineering Related content Interatomic potentials for Ti-Al with and without angular forces Interatomic potentials for Ti-AI with and without angular forces}, year = {1994}, file = {/home/aselimov/docs/My Library/files/643/Farkas, Jones - 1994 - Modelling and Simulation in Materials Science and Engineering Related content Interatomic potentials for Ti-Al(2).pdf} } @article{feyel_multilevel_2003, author = {Feyel, Fr??d??ric}, - title = {A multilevel finite element method ({FE2}) to describe the response of highly non-linear structures using generalized continua}, + title = {A multilevel finite element method (FE2) to describe the response of highly non-linear structures using generalized continua}, journal = {Computer Methods in Applied Mechanics and Engineering}, year = {2003}, number = {28-30}, @@ -1134,13 +1989,13 @@ write$ -- 0 number = {4-2}, volume = {119/120}, pages = {351--357}, - url = {https://doi.org/10.1023%2Fa%3A1024967510917}, + url = {https://doi.org/10.1023\%2Fa\%3A1024967510917}, doi = {10.1023/a:1024967510917} } @article{foiles_embedded-atom-method_1986, author = {Foiles, S. M. and Baskes, M. I. and Daw, M. S.}, - title = {Embedded-atom-method functions for the fcc metals {Cu}, {Ag}, {Au}, {Ni}, {Pd}, {Pt}, and their alloys}, + title = {Embedded-atom-method functions for the fcc metals Cu, Ag, Au, Ni, Pd, Pt, and their alloys}, journal = {Physical Review B}, year = {1986}, number = {12}, @@ -1162,10 +2017,20 @@ write$ -- 0 number = {5}, volume = {18}, pages = {459--466}, - url = {https://doi.org/10.1016%2F0898-1221%2889%2990240-x}, + url = {https://doi.org/10.1016\%2F0898-1221\%2889\%2990240-x}, doi = {10.1016/0898-1221(89)90240-x} } +@article{fu2018effect, + author = {Fu, Zhengrong and Zhang, Zheng and Meng, Lifang and Shu, Baipo and Zhu, Yuntian and Zhu, Xinkun}, + title = {Effect of strain rate on mechanical properties of Cu/Ni multilayered composites processed by electrodeposition}, + journal = {Materials Science and Engineering: A}, + publisher = {Elsevier}, + year = {2018}, + volume = {726}, + pages = {154--159} +} + @article{fu_molecular_2016, author = {Fu, Tao and Peng, Xianghe and Chen, Xiang and Weng, Shayuan and Hu, Ning and Li, Qibin and Wang, Zhongchang}, title = {Molecular dynamics simulation of nanoindentation on Cu/Ni nanotwinned multilayer films using a spherical indenter}, @@ -1185,7 +2050,7 @@ write$ -- 0 @article{furuhara_computer_1991, author = {Furuhara, T. and Aaronson, H. I.}, - title = {Computer modeling of partially coherent {B}.{C}.{C}.:{H}.{C}.{P}. boundaries}, + title = {Computer modeling of partially coherent B.C.C.:H.C.P. boundaries}, journal = {Acta Metallurgica Et Materialia}, year = {1991}, number = {11}, @@ -1199,7 +2064,7 @@ write$ -- 0 @article{furuhara_interphase_1990, author = {Furuhara, T. and Lee, H. J. and Menon, E. S.K. and Aaronson, H. I.}, - title = {Interphase boundary structures associated with diffusional phase transformations in {Ti}-base alloys}, + title = {Interphase boundary structures associated with diffusional phase transformations in Ti-base alloys}, journal = {Metallurgical Transactions A}, year = {1990}, number = {6}, @@ -1211,9 +2076,16 @@ write$ -- 0 issn = {03602133} } +@book{gamburg2011theory, + author = {Gamburg, Yuliy D and Zangari, Giovanni}, + title = {Theory and practice of metal electrodeposition}, + publisher = {Springer Science \& Business Media}, + year = {2011} +} + @article{gang_role_2017, author = {Gang, Chen and ChuanJie, Wang and Peng, Zhang}, - title = {The role of interface in uniaxial tensile process of nano-scale bilayer {Cu}/{Ni}}, + title = {The role of interface in uniaxial tensile process of nano-scale bilayer Cu/Ni}, journal = {Computational Materials Science}, year = {2017}, month = {April}, @@ -1229,7 +2101,7 @@ write$ -- 0 @article{glaessgen_modeling_2010, author = {Glaessgen, E H and Saether, E and Hochhalter, J D and Yamakov, V}, - title = {Modeling {Near}-{Crack}-{Tip} {Plasticity} {From} {Nano}- to {Micro}-{Scales}}, + title = {Modeling Near-Crack-Tip Plasticity From Nano- to Micro-Scales}, journal = {51st AIAA/ASME/ASCE/AHS/ASC Structures, Structural Dynamics, and Materials Conference}, year = {2010}, pages = {1--21}, @@ -1237,6 +2109,38 @@ write$ -- 0 file = {/home/aselimov/docs/My Library/files/659/Glaessgen et al. - 2010 - Modeling Near-Crack-Tip Plasticity From Nano- to Micro-Scales(2).pdf} } +@inproceedings{gola2018structure, + author = {Gola, A and Pastewka, L and Binder, K and Müller, M and Trautmann, A}, + title = {Structure of interfaces in Cu| Au nanolaminates}, + year = {2018}, + pages = {247--254}, + booktitle = {NIC Symposium} +} + +@article{Gola_2018, + author = {Gola, Adrien and Gumbsch, Peter and Pastewka, Lars}, + title = {Atomic-scale simulation of structure and mechanical properties of Cu1-xAgx$|$Ni multilayer systems}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2018}, + month = {may}, + volume = {150}, + pages = {236--247}, + url = {https://doi.org/10.1016\%2Fj.actamat.2018.02.046}, + doi = {10.1016/j.actamat.2018.02.046} +} + +@misc{gplv3, + title = {GNU General Public License}, + url = {http://www.gnu.org/licenses/gpl.html}, + date = {2007-06-29}, + language = {english}, + organization = {Free Software Foundation}, + pagination = {section}, + shorthand = {GPL}, + version = {3} +} + @article{gracie_adaptive_2011, author = {Gracie, Robert and Belytschko, Ted}, title = {An adaptive concurrent multiscale method for the dynamic simulation of dislocations}, @@ -1255,7 +2159,7 @@ write$ -- 0 @article{gracie_concurrently_2009, author = {Gracie, Robert and Belytschko, Ted}, - title = {Concurrently coupled atomistic and {XFEM} models for dislocations and cracks}, + title = {Concurrently coupled atomistic and XFEM models for dislocations and cracks}, journal = {International Journal for Numerical Methods in Engineering}, year = {2009}, month = {April}, @@ -1271,7 +2175,7 @@ write$ -- 0 @article{gracie_new_2008, author = {Gracie, Robert and Oswald, Jay and Belytschko, Ted}, - title = {On a new extended finite element method for dislocations: {Core} enrichment and nonlinear formulation}, + title = {On a new extended finite element method for dislocations: Core enrichment and nonlinear formulation}, journal = {Journal of the Mechanics and Physics of Solids}, year = {2008}, number = {1}, @@ -1294,13 +2198,13 @@ write$ -- 0 number = {9}, volume = {38}, pages = {3595--3603}, - url = {https://doi.org/10.1063%2F1.1710178}, + url = {https://doi.org/10.1063\%2F1.1710178}, doi = {10.1063/1.1710178} } @article{grujicic_molecular_1996, author = {Grujicic, M. and Dang, P.}, - title = {A molecular dynamics study of transformation toughening in the gamma {TiAl}/beta {Ti}-{V} system}, + title = {A molecular dynamics study of transformation toughening in the gamma TiAl/beta Ti-V system}, journal = {Materials Science and Engineering A}, year = {1996}, volume = {219}, @@ -1316,10 +2220,24 @@ write$ -- 0 month = {apr}, volume = {175}, pages = {109584}, - url = {https://doi.org/10.1016%2Fj.commatsci.2020.109584}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2020.109584}, doi = {10.1016/j.commatsci.2020.109584} } +@article{Gurrappa_2008, + author = {Gurrappa, Injeti and Binder, Leo}, + title = {Electrodeposition of nanostructured coatings and their characterization—A review}, + journal = {Science and Technology of Advanced Materials}, + publisher = {Informa UK Limited}, + year = {2008}, + month = {dec}, + number = {4}, + volume = {9}, + pages = {043001}, + url = {https://doi.org/10.1088\%2F1468-6996\%2F9\%2F4\%2F043001}, + doi = {10.1088/1468-6996/9/4/043001} +} + @article{hadian_atomistic_2016, author = {Hadian, R. and Grabowski, B. and Race, C. P. and Neugebauer, J.}, title = {Atomistic migration mechanisms of atomically flat, stepped, and kinked grain boundaries}, @@ -1329,7 +2247,7 @@ write$ -- 0 volume = {94}, pages = {1--10}, doi = {10.1103/PhysRevB.94.165413}, - abstract = {© 2016 American Physical Society.We studied the migration behavior of mixed tilt and twist grain boundaries in the vicinity of a symmetric tilt (111) Σ7 grain boundary in aluminum. We show that these grain boundaries fall into two main categories of stepped and kinked grain boundaries around the atomically flat symmetric tilt boundary. Using these structures together with size converged molecular dynamics simulations and investigating snapshots of the boundaries during migration, we obtain an intuitive and quantitative description of the kinetic and atomistic mechanisms of the migration of general mixed grain boundaries. This description is closely related to well-known concepts in surface growth such as step and kink-flow mechanisms and allows us to derive analytical kinetic models that explain the dependence of the migration barrier on the driving force. Using this insight we are able to extract energy barrier data for the experimentally relevant case of vanishing driving forces that are not accessible from direct molecular dynamics simulations and to classify arbitrary boundaries based on their mesoscopic structures.}, + abstract = {© 2016 American Physical Society.We studied the migration behavior of mixed tilt and twist grain boundaries in the vicinity of a symmetric tilt (111) $Σ$7 grain boundary in aluminum. We show that these grain boundaries fall into two main categories of stepped and kinked grain boundaries around the atomically flat symmetric tilt boundary. Using these structures together with size converged molecular dynamics simulations and investigating snapshots of the boundaries during migration, we obtain an intuitive and quantitative description of the kinetic and atomistic mechanisms of the migration of general mixed grain boundaries. This description is closely related to well-known concepts in surface growth such as step and kink-flow mechanisms and allows us to derive analytical kinetic models that explain the dependence of the migration barrier on the driving force. Using this insight we are able to extract energy barrier data for the experimentally relevant case of vanishing driving forces that are not accessible from direct molecular dynamics simulations and to classify arbitrary boundaries based on their mesoscopic structures.}, file = {/home/aselimov/docs/My Library/files/701/Hadian et al. - 2016 - Atomistic migration mechanisms of atomically flat, stepped, and kinked grain boundaries.pdf}, issn = {24699969} } @@ -1345,7 +2263,7 @@ write$ -- 0 @article{hardy_formulas_1982, author = {Hardy, Robert J}, - title = {Formulas for determining local properties in molecular dynamics simulations: {Shock} waves}, + title = {Formulas for determining local properties in molecular dynamics simulations: Shock waves}, journal = {The Journal of chemical physics}, year = {1982}, number = {1}, @@ -1358,7 +2276,7 @@ write$ -- 0 @article{hasnaoui_interaction_2004, author = {Hasnaoui, A. and Derlet, P. M. and Van Swygenhoven, H.}, - title = {Interaction between dislocations and grain boundaries under an indenter - {A} molecular dynamics simulation}, + title = {Interaction between dislocations and grain boundaries under an indenter - A molecular dynamics simulation}, journal = {Acta Materialia}, year = {2004}, number = {8}, @@ -1379,7 +2297,7 @@ write$ -- 0 month = {jul}, number = {2}, volume = {74}, - url = {https://doi.org/10.1103%2Fphysrevb.74.020102}, + url = {https://doi.org/10.1103\%2Fphysrevb.74.020102}, doi = {10.1103/physrevb.74.020102} } @@ -1393,7 +2311,7 @@ write$ -- 0 number = {22}, volume = {113}, pages = {9901--9904}, - url = {https://doi.org/10.1063%2F1.1329672}, + url = {https://doi.org/10.1063\%2F1.1329672}, doi = {10.1063/1.1329672} } @@ -1406,7 +2324,7 @@ write$ -- 0 month = {feb}, volume = {247}, pages = {106949}, - url = {https://doi.org/10.1016%2Fj.cpc.2019.106949}, + url = {https://doi.org/10.1016\%2Fj.cpc.2019.106949}, doi = {10.1016/j.cpc.2019.106949} } @@ -1420,7 +2338,7 @@ write$ -- 0 number = {9}, volume = {19}, pages = {1271--1296}, - url = {https://doi.org/10.1016%2Fs0749-6419%2802%2900016-5}, + url = {https://doi.org/10.1016\%2Fs0749-6419\%2802\%2900016-5}, doi = {10.1016/s0749-6419(02)00016-5} } @@ -1433,13 +2351,13 @@ write$ -- 0 month = {dec}, volume = {197}, pages = {212--219}, - url = {https://doi.org/10.1016%2Fj.cpc.2015.07.012}, + url = {https://doi.org/10.1016\%2Fj.cpc.2015.07.012}, doi = {10.1016/j.cpc.2015.07.012} } @inproceedings{hirschmann_towards_2016, author = {Hirschmann, Steffen and Pfluger, Dirk and Glass, Colin W.}, - title = {Towards {Understanding} {Optimal} {Load}-{Balancing} of {Heterogeneous} {Short}-{Range} {Molecular} {Dynamics}}, + title = {Towards Understanding Optimal Load-Balancing of Heterogeneous Short-Range Molecular Dynamics}, publisher = {IEEE}, year = {2016}, month = {December}, @@ -1447,7 +2365,7 @@ write$ -- 0 url = {http://ieeexplore.ieee.org/document/7837060/}, doi = {10.1109/HiPCW.2016.027}, abstract = {For heterogeneous dynamic short-range molecular dynamics simulations it is critical to employ suitable load-balancing methods to minimize the time to solution. However, designing and parametrizing the optimal load-balancing method is a complex task, depending on detailed properties of the simulation scenario.The main challenge in balancing the load of molecular dynamics simulations is the extreme difference in load density for scenarios with heterogeneous particle density, which can easily reach 4-6 orders of magnitude. Therefore, heterogeneity is deemed to be a relevant property and a suitable metric to reliably quantifying heterogeneity is formulated. This metric, which is based on binning particles and evaluating statistical moments, is then applied to example scenarios and correlated to the performance of five load balancing methodologies. Furthermore, how rapidly the load varies over time will determine how long the benefits of a specific partitioning are expected to last. We deem this to be another relevant property, the dynamics, and introduce corresponding metrics. The results indicate that these metric are useful to differentiate between scenarios and facilitate reasoning over the complex relationship between particle simulation scenarios and optimal load balancing methods. This work is a first step towards understanding this relationship, while introducing key concepts we regard as a crucial for this understanding.}, - booktitle = {2016 {IEEE} 23rd {International} {Conference} on {High} {Performance} {Computing} {Workshops} ({HiPCW})}, + booktitle = {2016 IEEE 23rd International Conference on High Performance Computing Workshops (HiPCW)}, file = {/home/aselimov/docs/My Library/files/671/Hirschmann, Pfluger, Glass - 2016 - Towards Understanding Optimal Load-Balancing of Heterogeneous Short-Range Molecular Dynamics.pdf}, isbn = {978-1-5090-5773-3}, keyword = {molecular dynamics method, methods, Computational modeling, distributed memory, dynamics, Dynamics, Force, heterogeneity, heterogeneous particle density, heterogeneous short-range molecular dynamics, inference mechanisms, linked-cell, load density, Load management, Load modeling, load-balancing, Measurement, optimal load-balancing method, parallel processing, parallelization, particle simulation scenarios, Partitioning algorithms, resource allocation, short-range molecular dynamics, spatial decomposition} @@ -1463,7 +2381,7 @@ write$ -- 0 number = {6}, volume = {50}, pages = {775--779}, - url = {https://doi.org/10.1016%2Fj.scriptamat.2003.11.059}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2003.11.059}, doi = {10.1016/j.scriptamat.2003.11.059} } @@ -1508,7 +2426,7 @@ write$ -- 0 month = {jul}, number = {1}, volume = {3}, - url = {https://doi.org/10.1038%2Fs41524-017-0031-1}, + url = {https://doi.org/10.1038\%2Fs41524-017-0031-1}, doi = {10.1038/s41524-017-0031-1} } @@ -1535,13 +2453,13 @@ write$ -- 0 number = {8}, volume = {53}, pages = {5584--5603}, - url = {https://doi.org/10.1007%2Fs10853-017-1844-5}, + url = {https://doi.org/10.1007\%2Fs10853-017-1844-5}, doi = {10.1007/s10853-017-1844-5} } @article{iacobellis_comparison_2013, author = {Iacobellis, Vincent and Behdinan, Kamran}, - title = {Comparison of {Concurrent} {Multiscale} {Methods} in the {Application} of {Fracture} in {Nickel}}, + title = {Comparison of Concurrent Multiscale Methods in the Application of Fracture in Nickel}, journal = {Journal of Applied Mechanics}, year = {2013}, number = {5}, @@ -1557,7 +2475,7 @@ write$ -- 0 @article{imrich_differences_2014, author = {Imrich, Peter J. and Kirchlechner, Christoph and Motz, Christian and Dehm, Gerhard}, - title = {Differences in deformation behavior of bicrystalline {Cu} micropillars containing a twin boundary or a large-angle grain boundary}, + title = {Differences in deformation behavior of bicrystalline Cu micropillars containing a twin boundary or a large-angle grain boundary}, journal = {Acta Materialia}, year = {2014}, month = {July}, @@ -1570,6 +2488,43 @@ write$ -- 0 issn = {1359-6454} } +@article{Jankowski_1995, + author = {Jankowski, Alan F.}, + title = {Metallic multilayers at the nanoscale}, + journal = {Nanostructured Materials}, + publisher = {Elsevier BV}, + year = {1995}, + month = {jan}, + number = {1-4}, + volume = {6}, + pages = {179--190}, + url = {https://doi.org/10.1016\%2F0965-9773\%2895\%2900041-0}, + doi = {10.1016/0965-9773(95)00041-0} +} + +@article{Jankowski_2007, + author = {Jankowski, Alan F.}, + title = {Diffusion Mechanisms in Nanocrystalline and Nanolaminated Au-Cu}, + journal = {Defect and Diffusion Forum}, + publisher = {Trans Tech Publications, Ltd.}, + year = {2007}, + month = {sep}, + volume = {266}, + pages = {13--28}, + url = {https://doi.org/10.4028\%2Fwww.scientific.net\%2Fddf.266.13}, + doi = {10.4028/www.scientific.net/ddf.266.13} +} + +@article{jian2020effects, + author = {Jian, Wu-Rong and Xie, Zhuocheng and Xu, Shuozhi and Su, Yanqing and Yao, Xiaohu and Beyerlein, Irene J}, + title = {Effects of lattice distortion and chemical short-range order on the mechanisms of deformation in medium entropy alloy CoCrNi}, + journal = {Acta Materialia}, + publisher = {Elsevier}, + year = {2020}, + volume = {199}, + pages = {352--369} +} + @article{Jian_2020, author = {Jian, Wu-Rong and Zhang, Min and Xu, Shuozhi and Beyerlein, Irene J.}, title = {Atomistic simulations of dynamics of an edge dislocation and its interaction with a void in copper: a comparative study}, @@ -1580,10 +2535,24 @@ write$ -- 0 number = {4}, volume = {28}, pages = {045004}, - url = {https://doi.org/10.1088%2F1361-651x%2Fab8358}, + url = {https://doi.org/10.1088\%2F1361-651x\%2Fab8358}, doi = {10.1088/1361-651x/ab8358} } +@article{Johnson_1996, + author = {Johnson, M T and Bloemen, P J H and Broeder, F J A den and de Vries, J J}, + title = {Magnetic anisotropy in metallic multilayers}, + journal = {Reports on Progress in Physics}, + publisher = {IOP Publishing}, + year = {1996}, + month = {nov}, + number = {11}, + volume = {59}, + pages = {1409--1458}, + url = {https://doi.org/10.1088\%2F0034-4885\%2F59\%2F11\%2F002}, + doi = {10.1088/0034-4885/59/11/002} +} + @article{Kacher_2019, author = {Kacher, Josh and Zhu, Ting and Pierron, Olivier and Spearot, Douglas E.}, title = {Integrating in situ TEM experiments and atomistic simulations for defect mechanics}, @@ -1594,13 +2563,20 @@ write$ -- 0 number = {3}, volume = {23}, pages = {117--128}, - url = {https://doi.org/10.1016%2Fj.cossms.2019.03.003}, + url = {https://doi.org/10.1016\%2Fj.cossms.2019.03.003}, doi = {10.1016/j.cossms.2019.03.003} } +@book{kanani2004electroplating, + author = {Kanani, Nasser}, + title = {Electroplating: basic principles, processes and practice}, + publisher = {Elsevier}, + year = {2004} +} + @article{kanani_stacking_2016, author = {Kanani, M. and Hartmaier, A. and Janisch, R.}, - title = {Stacking fault based analysis of shear mechanisms at interfaces in lamellar {TiAl} alloys}, + title = {Stacking fault based analysis of shear mechanisms at interfaces in lamellar TiAl alloys}, journal = {Acta Materialia}, year = {2016}, volume = {106}, @@ -1637,13 +2613,13 @@ write$ -- 0 month = {feb}, volume = {63}, pages = {94--112}, - url = {https://doi.org/10.1016%2Fj.jmps.2013.10.001}, + url = {https://doi.org/10.1016\%2Fj.jmps.2013.10.001}, doi = {10.1016/j.jmps.2013.10.001} } @article{kim_modified_2006, author = {Kim, Young Min and Lee, Byeong Joo and Baskes, M. I.}, - title = {Modified embedded-atom method interatomic potentials for {Ti} and {Zr}}, + title = {Modified embedded-atom method interatomic potentials for Ti and Zr}, journal = {Physical Review B - Condensed Matter and Materials Physics}, year = {2006}, number = {1}, @@ -1678,7 +2654,7 @@ write$ -- 0 number = {23}, volume = {6}, pages = {eaaz1187}, - url = {https://doi.org/10.1126%2Fsciadv.aaz1187}, + url = {https://doi.org/10.1126\%2Fsciadv.aaz1187}, doi = {10.1126/sciadv.aaz1187} } @@ -1692,10 +2668,20 @@ write$ -- 0 number = {17-18}, volume = {82}, pages = {3375--3381}, - url = {https://doi.org/10.1080%2F01418610208240448}, + url = {https://doi.org/10.1080\%2F01418610208240448}, doi = {10.1080/01418610208240448} } +@article{krasnikov2020prediction, + author = {Krasnikov, Vasiliy S and Mayer, Alexander E and Pogorelko, Viсtor V}, + title = {Prediction of the shear strength of aluminum with $þeta$ phase inclusions based on precipitate statistics, dislocation and molecular dynamics}, + journal = {International Journal of Plasticity}, + publisher = {Elsevier}, + year = {2020}, + volume = {128}, + pages = {102672} +} + @article{Kuhr_2016, author = {Kuhr, Bryan and Farkas, Diana and Robertson, Ian M.}, title = {Atomistic studies of hydrogen effects on grain boundary structure and deformation response in FCC Ni}, @@ -1705,22 +2691,49 @@ write$ -- 0 month = {sep}, volume = {122}, pages = {92--101}, - url = {https://doi.org/10.1016%2Fj.commatsci.2016.05.014}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2016.05.014}, doi = {10.1016/j.commatsci.2016.05.014} } @article{kumar_m_d_german_c_f_shih_engineering_1981, author = {Kumar M D German C F Shih, Authors V}, - title = {An {Engineering} {Approach} for {Elastic}-{Plastic} {Fracture} {Analysis}}, + title = {An Engineering Approach for Elastic-Plastic Fracture Analysis}, year = {1981}, abstract = {(415) 965,4081 There is no charge for reports requested by EPRI member utilities and affiliates, contributing nonmembers, U.S, utility associations, U.S. government agencies (federal, state, and local), media, and foreign organizations with which EPRI has an information exchange agreement. On request, RRC will send a catalog of EPRI reports.}, file = {/home/aselimov/docs/My Library/files/843/Kumar M D German C F Shih - 1981 - An Engineering Approach for Elastic-Plastic Fracture Analysis(2).pdf}, - keyword = {\_, · · c Keywords-, Fracture Han∼∼C)Qk} + keyword = {_, · · c Keywords-, Fracture Han∼∼C)Qk} +} + +@article{Lashmore_1988, + author = {Lashmore, D. S. and Dariel, M. P.}, + title = {Electrodeposited Cu-Ni Textured Superlattices}, + journal = {Journal of The Electrochemical Society}, + publisher = {The Electrochemical Society}, + year = {1988}, + month = {may}, + number = {5}, + volume = {135}, + pages = {1218--1221}, + url = {https://doi.org/10.1149\%2F1.2095930}, + doi = {10.1149/1.2095930} +} + +@article{Lehtinen_2016, + author = {Lehtinen, Arttu and Granberg, Fredric and Laurson, Lasse and Nordlund, Kai and Alava, Mikko J.}, + title = {Multiscale modeling of dislocation-precipitate interactions in Fe: From molecular dynamics to discrete dislocations}, + journal = {Physical Review E}, + publisher = {American Physical Society (APS)}, + year = {2016}, + month = {jan}, + number = {1}, + volume = {93}, + url = {https://doi.org/10.1103\%2Fphysreve.93.013309}, + doi = {10.1103/physreve.93.013309} } @book{lesar_introduction_2013, author = {Lesar, Richard}, - title = {Introduction to {Computational} {Materials} {Science}: {Fundamentals} to {Applications}}, + title = {Introduction to Computational Materials Science: Fundamentals to Applications}, year = {2013}, url = {www.cambridge.org/9780521845878}, doi = {10.1017/CBO9781139033398}, @@ -1740,7 +2753,7 @@ write$ -- 0 number = {4}, volume = {63}, pages = {363--366}, - url = {https://doi.org/10.1016%2Fj.scriptamat.2010.04.005}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2010.04.005}, doi = {10.1016/j.scriptamat.2010.04.005} } @@ -1754,13 +2767,26 @@ write$ -- 0 number = {13}, volume = {34}, pages = {2306--2314}, - url = {https://doi.org/10.1557%2Fjmr.2019.69}, + url = {https://doi.org/10.1557\%2Fjmr.2019.69}, doi = {10.1557/jmr.2019.69} } +@article{Li_2019a, + author = {Li, Yang and Li, Weixuan and Chen, Xiang and Diaz, Adrian and McDowell, David L. and Chen, Youping}, + title = {Phonon spectrum and phonon focusing in coarse-grained atomistic simulations}, + journal = {Computational Materials Science}, + publisher = {Elsevier BV}, + year = {2019}, + month = {may}, + volume = {162}, + pages = {21--32}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2019.02.020}, + doi = {10.1016/j.commatsci.2019.02.020} +} + @article{li_direct_2012, author = {Li, Nan and Wang, Jian and Misra, Amit and Huang, Jian Yu}, - title = {Direct {Observations} of {Confined} {Layer} {Slip} in {Cu}/{Nb} {Multilayers}}, + title = {Direct Observations of Confined Layer Slip in Cu/Nb Multilayers}, journal = {Microscopy and Microanalysis}, year = {2012}, month = {October}, @@ -1769,7 +2795,7 @@ write$ -- 0 pages = {1155--1162}, url = {http://www.journals.cambridge.org/abstract_S143192761200133X}, doi = {10.1017/S143192761200133X}, - abstract = {{\textbackslash}textlessdiv class="abstract" data-abstract-type="normal"{\textbackslash}textgreater {\textbackslash}textlessp{\textbackslash}textgreater {\textbackslash}textlessspan class='italic'{\textbackslash}textgreaterIn situ{\textbackslash}textless/span{\textbackslash}textgreater nanoindentation of a 30 nm Cu/20 nm Nb multilayer film in a transmission electron microscope revealed confined layer slip as the dominant deformation mechanism. Dislocations were observed to nucleate from the Cu-Nb interfaces in both layers. Dislocation glide was confined by interfaces to occur within each layer, without transmission across interfaces. Cu and Nb layers co-deformed to large plastic strains without cracking. These microscopy observations provide insights in the unit mechanisms of deformation, work hardening, and recovery in nanoscale metallic multilayers.{\textbackslash}textless/p{\textbackslash}textgreater {\textbackslash}textless/div{\textbackslash}textgreater}, + abstract = {\textlessdiv class="abstract" data-abstract-type="normal"\textgreater \textlessp\textgreater \textlessspan class='italic'\textgreaterIn situ\textless/span\textgreater nanoindentation of a 30 nm Cu/20 nm Nb multilayer film in a transmission electron microscope revealed confined layer slip as the dominant deformation mechanism. Dislocations were observed to nucleate from the Cu-Nb interfaces in both layers. Dislocation glide was confined by interfaces to occur within each layer, without transmission across interfaces. Cu and Nb layers co-deformed to large plastic strains without cracking. These microscopy observations provide insights in the unit mechanisms of deformation, work hardening, and recovery in nanoscale metallic multilayers.\textless/p\textgreater \textless/div\textgreater}, file = {/home/aselimov/docs/My Library/files/868/Li et al. - 2012 - Direct Observations of Confined Layer Slip in CuNb Multilayers.pdf}, issn = {1431-9276}, keyword = {confined layer slip, Cu-Nb interfaces, in situ indentation} @@ -1791,9 +2817,23 @@ write$ -- 0 keyword = {Grain boundaries, Dislocations (Crystals), Metal crystals, Nanotechnology, Nucleation (Physics)} } +@article{li_role_2018, + author = {Li, Yi and Zhou, Qing and Zhang, Shuang and Huang, Ping and Xu, Kewei and Wang, Fei and Lu, Tianjian}, + title = {On the role of weak interface in crack blunting process in nanoscale layered composites}, + journal = {Applied Surface Science}, + year = {2018}, + volume = {433}, + pages = {957--962}, + doi = {10.1016/j.apsusc.2017.10.002}, + abstract = {Heterointerface in a nanoscale metallic layered composite could improve its crack resistance. However, the influence of metallic interface structures on crack propagation has not been well understood at atomic scale. By using the method of molecular dynamics (MD) simulation, the crack propagation behavior in Cu-Nb bilayer is compared with that in Cu-Ni bilayer. We find that the weak Cu-Nb interface plays an important role in hindering crack propagation in two ways: (i) dislocation nucleation at the interface releases stress concentration for the crack to propagate; (ii) the easily sheared weak incoherent interface blunts the crack tip. The results are helpful for understanding the interface structure dependent crack resistance of nanoscale bicrystal interfaces.}, + file = {/home/aselimov/docs/My Library/files/616/Li et al. - 2018 - On the role of weak interface in crack blunting process in nanoscale layered composites.pdf}, + issn = {01694332}, + keyword = {Dislocation, Molecular dynamics, Fracture, Crack, Interface} +} + @article{lin_measuring_2016, author = {Lin, Neil Y. C. and Bierbaum, Matthew and Schall, Peter and Sethna, James P. and Cohen, Itai}, - title = {Measuring nonlinear stresses generated by defects in {3D} colloidal crystals}, + title = {Measuring nonlinear stresses generated by defects in 3D colloidal crystals}, journal = {Nature Materials}, year = {2016}, number = {11}, @@ -1808,20 +2848,6 @@ write$ -- 0 pmid = {27479210} } -@article{li_role_2018, - author = {Li, Yi and Zhou, Qing and Zhang, Shuang and Huang, Ping and Xu, Kewei and Wang, Fei and Lu, Tianjian}, - title = {On the role of weak interface in crack blunting process in nanoscale layered composites}, - journal = {Applied Surface Science}, - year = {2018}, - volume = {433}, - pages = {957--962}, - doi = {10.1016/j.apsusc.2017.10.002}, - abstract = {Heterointerface in a nanoscale metallic layered composite could improve its crack resistance. However, the influence of metallic interface structures on crack propagation has not been well understood at atomic scale. By using the method of molecular dynamics (MD) simulation, the crack propagation behavior in Cu-Nb bilayer is compared with that in Cu-Ni bilayer. We find that the weak Cu-Nb interface plays an important role in hindering crack propagation in two ways: (i) dislocation nucleation at the interface releases stress concentration for the crack to propagate; (ii) the easily sheared weak incoherent interface blunts the crack tip. The results are helpful for understanding the interface structure dependent crack resistance of nanoscale bicrystal interfaces.}, - file = {/home/aselimov/docs/My Library/files/616/Li et al. - 2018 - On the role of weak interface in crack blunting process in nanoscale layered composites.pdf}, - issn = {01694332}, - keyword = {Dislocation, Molecular dynamics, Fracture, Crack, Interface} -} - @article{Liu_2017, author = {Liu, Xuying and Hao, Rui and Mao, Shimin and Dillon, Shen J.}, title = {Shear strengths of FCC-FCC cube-on-cube interfaces}, @@ -1831,7 +2857,7 @@ write$ -- 0 month = {mar}, volume = {130}, pages = {178--181}, - url = {https://doi.org/10.1016%2Fj.scriptamat.2016.11.038}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2016.11.038}, doi = {10.1016/j.scriptamat.2016.11.038} } @@ -1844,7 +2870,7 @@ write$ -- 0 month = {nov}, volume = {25}, pages = {60--65}, - url = {https://doi.org/10.1016%2Fj.eml.2018.10.007}, + url = {https://doi.org/10.1016\%2Fj.eml.2018.10.007}, doi = {10.1016/j.eml.2018.10.007} } @@ -1873,6 +2899,19 @@ write$ -- 0 file = {/home/aselimov/docs/My Library/files/720/Rawat et al. - 2002 - Modelling and Simulation in Materials Science and Engineering Related content Instability of hcp structures in mod.pdf} } +@article{Malka_Markovitz_2021, + author = {Malka-Markovitz, Alon and Devincre, Benoit and Mordehai, Dan}, + title = {A molecular dynamics-informed probabilistic cross-slip model in discrete dislocation dynamics}, + journal = {Scripta Materialia}, + publisher = {Elsevier BV}, + year = {2021}, + month = {jan}, + volume = {190}, + pages = {7--11}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2020.08.008}, + doi = {10.1016/j.scriptamat.2020.08.008} +} + @article{Mara_2015, author = {Mara, Nathan A. and Beyerlein, Irene J.}, title = {Interface-dominant multilayers fabricated by severe plastic deformation: Stability under extreme conditions}, @@ -1883,7 +2922,7 @@ write$ -- 0 number = {5}, volume = {19}, pages = {265--276}, - url = {https://doi.org/10.1016%2Fj.cossms.2015.04.002}, + url = {https://doi.org/10.1016\%2Fj.cossms.2015.04.002}, doi = {10.1016/j.cossms.2015.04.002} } @@ -1897,7 +2936,7 @@ write$ -- 0 number = {3}, volume = {56}, pages = {869--895}, - url = {https://doi.org/10.1016%2Fj.jmps.2007.06.014}, + url = {https://doi.org/10.1016\%2Fj.jmps.2007.06.014}, doi = {10.1016/j.jmps.2007.06.014} } @@ -1935,9 +2974,23 @@ write$ -- 0 keyword = {Simulation, Hardness, Nanostructure} } +@article{Matsushima_2007, + author = {Matsushima, Hisayoshi and Bund, Andreas and Plieth, Waldfried and Kikuchi, Shiomi and Fukunaka, Yasuhiro}, + title = {Copper electrodeposition in a magnetic field}, + journal = {Electrochimica Acta}, + publisher = {Elsevier BV}, + year = {2007}, + month = {nov}, + number = {1}, + volume = {53}, + pages = {161--166}, + url = {https://doi.org/10.1016\%2Fj.electacta.2007.01.043}, + doi = {10.1016/j.electacta.2007.01.043} +} + @article{matthews_defects_1975, author = {Matthews, J.W. and Blakeslee, A.E.}, - title = {Defects in epitaxial multilayers: {II}. {Dislocation} pile-ups, threading dislocations, slip lines and cracks}, + title = {Defects in epitaxial multilayers: II. Dislocation pile-ups, threading dislocations, slip lines and cracks}, journal = {Journal of Crystal Growth}, year = {1975}, month = {July}, @@ -1959,7 +3012,7 @@ write$ -- 0 year = {2018}, month = {nov}, pages = {195--297}, - url = {https://doi.org/10.1007%2F978-3-319-94186-8_5}, + url = {https://doi.org/10.1007\%2F978-3-319-94186-8_5}, doi = {10.1007/978-3-319-94186-8_5}, booktitle = {Mesoscale Models} } @@ -1980,6 +3033,20 @@ write$ -- 0 keyword = {Grain boundaries, Plasticity, Multiscale, Gradient, Scale effects} } +@article{McKeown_2002, + author = {McKeown, J. and Misra, A. and Kung, H. and Hoagland, R. G. and Nastasi, M.}, + title = {Microstructures and strength of nanoscale Cu–Ag multilayers}, + journal = {Scripta Materialia}, + publisher = {Elsevier BV}, + year = {2002}, + month = {apr}, + number = {8}, + volume = {46}, + pages = {593--598}, + url = {https://doi.org/10.1016\%2Fs1359-6462\%2802\%2900036-2}, + doi = {10.1016/s1359-6462(02)00036-2} +} + @article{Medyanik_2009, author = {Medyanik, Sergey N. and Shao, Shuai}, title = {Strengthening effects of coherent interfaces in nanoscale metallic bilayers}, @@ -1990,7 +3057,7 @@ write$ -- 0 number = {4}, volume = {45}, pages = {1129--1133}, - url = {https://doi.org/10.1016%2Fj.commatsci.2009.01.013}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2009.01.013}, doi = {10.1016/j.commatsci.2009.01.013} } @@ -2052,6 +3119,19 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer keyword = {Dislocations, Thin films, Nanostructured materials} } +@article{Miura_2015, + author = {Miura, Terumitsu and Fujii, Katsuhiko and Fukuya, Koji}, + title = {Micro-mechanical investigation for effects of helium on grain boundary fracture of austenitic stainless steel}, + journal = {Journal of Nuclear Materials}, + publisher = {Elsevier BV}, + year = {2015}, + month = {feb}, + volume = {457}, + pages = {279--290}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2014.11.062}, + doi = {10.1016/j.jnucmat.2014.11.062} +} + @article{Moering_2015, author = {Moering, Jordan and Ma, Xiaolong and Chen, Guizhen and Miao, Pifeng and Li, Guozhong and Qian, Gang and Mathaudhu, Suveen and Zhu, Yuntian}, title = {The role of shear strain on texture and microstructural gradients in low carbon steel processed by Surface Mechanical Attrition Treatment}, @@ -2061,13 +3141,26 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {nov}, volume = {108}, pages = {100--103}, - url = {https://doi.org/10.1016%2Fj.scriptamat.2015.06.027}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2015.06.027}, doi = {10.1016/j.scriptamat.2015.06.027} } +@article{N_hring_2018, + author = {Nöhring, Wolfram Georg and Curtin, W. A.}, + title = {Cross-slip of long dislocations in FCC solid solutions}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2018}, + month = {oct}, + volume = {158}, + pages = {95--117}, + url = {https://doi.org/10.1016\%2Fj.actamat.2018.05.027}, + doi = {10.1016/j.actamat.2018.05.027} +} + @book{narita_crack-tip_1989, author = {Narita, Nobutaka and Higashida, Kenji and Torii, Takeshi}, - title = {Crack-tip {Shielding} by {Dislocation} and {Fracture} {Toughness} in {NaCl} {Crystals}}, + title = {Crack-tip Shielding by Dislocation and Fracture Toughness in NaCl Crystals}, year = {1989}, number = {11}, volume = {30}, @@ -2075,6 +3168,32 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer file = {/home/aselimov/docs/My Library/files/862/Narita, Higashida, Torii - 1989 - Crack-tip Shielding by Dislocation and Fracture Toughness in NaCl Crystals(2).pdf} } +@article{Nasim_2019, + author = {Nasim, Mohammad and Li, Yuncang and Wen, Cuie}, + title = {Individual layer thickness-dependent microstructures and mechanical properties of fcc/fcc Ni/Al nanolaminates and their strengthening mechanisms}, + journal = {Materialia}, + publisher = {Elsevier BV}, + year = {2019}, + month = {jun}, + volume = {6}, + pages = {100347}, + url = {https://doi.org/10.1016\%2Fj.mtla.2019.100347}, + doi = {10.1016/j.mtla.2019.100347} +} + +@article{Nasim_2020, + author = {Nasim, Mohammad and Li, Yuncang and Wen, Cuie}, + title = {Length-scale dependent deformation, strengthening, and ductility of fcc/fcc Ni/Al nanolaminates using micropillar compression testing}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2020}, + month = {jul}, + volume = {193}, + pages = {318--328}, + url = {https://doi.org/10.1016\%2Fj.actamat.2020.04.043}, + doi = {10.1016/j.actamat.2020.04.043} +} + @article{Ney_1977, author = {Ney, H. and Labusch, R. and Haasen, P.}, title = {Measurement of dislocation velocities in Cu-Al single crystals—II}, @@ -2085,23 +3204,10 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {11}, volume = {25}, pages = {1257--1269}, - url = {https://doi.org/10.1016%2F0001-6160%2877%2990102-x}, + url = {https://doi.org/10.1016\%2F0001-6160\%2877\%2990102-x}, doi = {10.1016/0001-6160(77)90102-x} } -@article{N_hring_2018, - author = {Nöhring, Wolfram Georg and Curtin, W. A.}, - title = {Cross-slip of long dislocations in FCC solid solutions}, - journal = {Acta Materialia}, - publisher = {Elsevier BV}, - year = {2018}, - month = {oct}, - volume = {158}, - pages = {95--117}, - url = {https://doi.org/10.1016%2Fj.actamat.2018.05.027}, - doi = {10.1016/j.actamat.2018.05.027} -} - @article{nieh_hall-petch_1991, author = {Nieh, T. G. and Wadsworth, J.}, title = {Hall-petch relation in nanocrystalline solids}, @@ -2118,7 +3224,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{nizolek_tensile_2016, author = {Nizolek, Thomas and Beyerlein, Irene J. and Mara, Nathan A. and Avallone, Jaclyn T. and Pollock, Tresa M.}, - title = {Tensile behavior and flow stress anisotropy of accumulative roll bonded {Cu}-{Nb} nanolaminates}, + title = {Tensile behavior and flow stress anisotropy of accumulative roll bonded Cu-Nb nanolaminates}, journal = {Applied Physics Letters}, year = {2016}, month = {February}, @@ -2134,11 +3240,11 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer } @incollection{noauthor_concurrent_nodate, - title = {Concurrent {Atomistic}-{Continuum} {Simulation} of {Defects} in {Polyatomic} {Ionic} {Materials}} + title = {Concurrent Atomistic-Continuum Simulation of Defects in Polyatomic Ionic Materials} } @book{noauthor_ref_62.pdf_nodate, - title = {Ref\_62.pdf} + title = {Ref_62.pdf} } @article{Nos__1991, @@ -2149,7 +3255,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer year = {1991}, volume = {103}, pages = {1--46}, - url = {https://doi.org/10.1143%2Fptps.103.1}, + url = {https://doi.org/10.1143\%2Fptps.103.1}, doi = {10.1143/ptps.103.1} } @@ -2169,18 +3275,55 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer issn = {0001-6160} } +@article{O_Boyle_2011, + author = {O'Boyle, Noel M and Banck, Michael and James, Craig A and Morley, Chris and Vandermeersch, Tim and Hutchison, Geoffrey R}, + title = {Open Babel: An open chemical toolbox}, + journal = {Journal of Cheminformatics}, + publisher = {Springer Science and Business Media LLC}, + year = {2011}, + month = {oct}, + number = {1}, + volume = {3}, + url = {https://doi.org/10.1186\%2F1758-2946-3-33}, + doi = {10.1186/1758-2946-3-33} +} + @article{of_colorado_lumped_2010, author = {of Colorado, University}, - title = {Lumped and {Consisitent} {Mass} {Matrices}}, + title = {Lumped and Consisitent Mass Matrices}, journal = {Introduction To Finite Element Mehtods}, year = {2010}, pages = {31.1--31.23}, file = {/home/aselimov/docs/My Library/files/696/Colorado - 2010 - Lumped and Consisitent Mass Matrices.pdf} } +@article{ogden1986high, + author = {Ogden, Cameron}, + title = {High-strength, composite copper-nickel electrodeposits}, + journal = {Plating and surface finishing}, + year = {1986}, + number = {5}, + volume = {73}, + pages = {130--134} +} + +@article{Ohsaki_2007, + author = {Ohsaki, S. and Kato, S. and Tsuji, N. and Ohkubo, T. and Hono, K.}, + title = {Bulk mechanical alloying of Cu–Ag and Cu/Zr two-phase microstructures by accumulative roll-bonding process}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2007}, + month = {may}, + number = {8}, + volume = {55}, + pages = {2885--2895}, + url = {https://doi.org/10.1016\%2Fj.actamat.2006.12.027}, + doi = {10.1016/j.actamat.2006.12.027} +} + @article{onat_optimized_2014, author = {Onat, Berk and Durukanoǧlu, Sondan}, - title = {An optimized interatomic potential for {Cu}-{Ni} alloys with the embedded-atom method}, + title = {An optimized interatomic potential for Cu-Ni alloys with the embedded-atom method}, journal = {Journal of Physics Condensed Matter}, year = {2014}, number = {3}, @@ -2193,9 +3336,49 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pmid = {24351396} } +@article{P_terffy_2020, + author = {Péterffy, Gábor and Ispánovity, Péter D. and Foster, Michael E. and Zhou, Xiaowang and Sills, Ryan B.}, + title = {Length scales and scale-free dynamics of dislocations in dense solid solutions}, + journal = {Materials Theory}, + publisher = {Springer Science and Business Media LLC}, + year = {2020}, + month = {nov}, + number = {1}, + volume = {4}, + url = {https://doi.org/10.1186\%2Fs41313-020-00023-z}, + doi = {10.1186/s41313-020-00023-z} +} + +@article{Pangarov_1964, + author = {Pangarov, N. A.}, + title = {On the crystal orientation of electrodeposited metals}, + journal = {Electrochimica Acta}, + publisher = {Elsevier BV}, + year = {1964}, + month = {jun}, + number = {6}, + volume = {9}, + pages = {721--726}, + url = {https://doi.org/10.1016\%2F0013-4686\%2864\%2980060-8}, + doi = {10.1016/0013-4686(64)80060-8} +} + +@article{Papanikolaou_2017, + author = {Papanikolaou, S. and Song, H. and der Giessen, E. Van}, + title = {Obstacles and sources in dislocation dynamics: Strengthening and statistics of abrupt plastic events in nanopillar compression}, + journal = {Journal of the Mechanics and Physics of Solids}, + publisher = {Elsevier BV}, + year = {2017}, + month = {may}, + volume = {102}, + pages = {17--29}, + url = {https://doi.org/10.1016\%2Fj.jmps.2017.02.004}, + doi = {10.1016/j.jmps.2017.02.004} +} + @article{parrinello_polymorphic_1981, author = {Parrinello, M. and Rahman, A.}, - title = {Polymorphic transitions in single crystals: {A} new molecular dynamics method}, + title = {Polymorphic transitions in single crystals: A new molecular dynamics method}, journal = {Journal of Applied Physics}, year = {1981}, month = {December}, @@ -2219,7 +3402,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {jun}, volume = {519}, pages = {265--273}, - url = {https://doi.org/10.1016%2Fj.jnucmat.2019.04.007}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2019.04.007}, doi = {10.1016/j.jnucmat.2019.04.007} } @@ -2232,7 +3415,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {aug}, volume = {672}, pages = {175--183}, - url = {https://doi.org/10.1016%2Fj.msea.2016.07.007}, + url = {https://doi.org/10.1016\%2Fj.msea.2016.07.007}, doi = {10.1016/j.msea.2016.07.007} } @@ -2252,9 +3435,29 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer keyword = {Dislocations, EAM potential, Stacking faults, Tunable twin boundaries} } +@article{pellicer2010nanocrystalline, + author = {Pellicer, Eva and Varea, Aı̈da and Pané, Salvador and Nelson, Bradley J and Menéndez, Enric and Estrader, Marta and Surinach, Santiago and Baró, Maria Dolors and Nogués, Josep and Sort, Jordi}, + title = {Nanocrystalline electroplated Cu--Ni: metallic thin films with enhanced mechanical properties and tunable magnetic behavior}, + journal = {Advanced functional materials}, + publisher = {Wiley Online Library}, + year = {2010}, + number = {6}, + volume = {20}, + pages = {983--991} +} + +@article{petch1953cleavage, + author = {Petch, NJ}, + title = {The cleavage strength of polycrystals}, + journal = {Journal of the Iron and Steel Institute}, + year = {1953}, + volume = {174}, + pages = {25--28} +} + @book{plimpton_fast_1995, author = {Plimpton, Steve}, - title = {Fast {Parallel} {Algorithms} for {Short}-{Range} {Molecular} {Dynamics}}, + title = {Fast Parallel Algorithms for Short-Range Molecular Dynamics}, year = {1995}, number = {1}, volume = {117}, @@ -2266,6 +3469,33 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pmid = {8987871} } +@article{Pluchino_2016, + author = {Pluchino, Paula A. and Chen, Xiang and Garcia, Marcus and Xiong, Liming and McDowell, David L. and Chen, Youping}, + title = {Dislocation migration across coherent phase interfaces in SiGe superlattices}, + journal = {Computational Materials Science}, + publisher = {Elsevier BV}, + year = {2016}, + month = {jan}, + volume = {111}, + pages = {1--6}, + url = {https://doi.org/10.1016\%2Fj.commatsci.2015.08.059}, + doi = {10.1016/j.commatsci.2015.08.059} +} + +@article{Po_2014, + author = {Po, Giacomo and Mohamed, Mamdouh S. and Crosby, Tamer and Erel, Can and El-Azab, Anter and Ghoniem, Nasr}, + title = {Recent Progress in Discrete Dislocation Dynamics and Its Applications to Micro Plasticity}, + journal = {JOM}, + publisher = {Springer Science and Business Media LLC}, + year = {2014}, + month = {sep}, + number = {10}, + volume = {66}, + pages = {2108--2120}, + url = {https://doi.org/10.1007\%2Fs11837-014-1153-2}, + doi = {10.1007/s11837-014-1153-2} +} + @article{potirniche_molecular_2006, author = {Potirniche, G.P. and Horstemeyer, M.F. and Wagner, G.J. and Gullett, P.M.}, title = {A molecular dynamics study of void growth and coalescence in single crystal nickel}, @@ -2277,7 +3507,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pages = {257--278}, url = {https://www.sciencedirect.com/science/article/pii/S0749641905000458}, doi = {10.1016/J.IJPLAS.2005.02.001}, - abstract = {Molecular dynamics simulations using Modified Embedded Atom Method (MEAM) potentials were performed to analyze material length scale influences on damage progression of single crystal nickel. Damage evolution by void growth and coalescence was simulated at very high strain rates (108–1010/s) involving four specimen sizes ranging from ≈5000 to 170,000 atoms with the same initial void volume fraction. 3D rectangular specimens with uniform thickness were provided with one and two embedded cylindrical voids and were subjected to remote uniaxial tension at a constant strain rate. Void volume fraction evolution and the corresponding stress–strain responses were monitored as the voids grew under the increasing applied tractions. The results showed that the specimen length scale changes the dislocation pattern, the evolving void aspect ratio, and the stress–strain response. At small strain levels (0–20\%), a damage evolution size scale effect can be observed from the damage-strain and stress–strain curves, which is consistent with dislocation nucleation argument of Horstemeyer et al. [Horstemeyer, M.F., Baskes, M.I., Plimpton, S.J., 2001a. Length scale and time scale effects on the plastic flow of FCC metals. Acta Mater. 49, pp. 4363–4374] playing a dominant role. However, when the void volume fraction evolution is plotted versus the applied true strain at large plastic strains ({\textbackslash}textgreater20\%), minimal size scale differences were observed, even with very different dislocation patterns occurring in the specimen. At this larger strain level, the size scale differences cease to be relevant, because the effects of dislocation nucleation were overcome by dislocation interaction. This study provides fodder for bridging material length scales from the nanoscale to the larger scales by examining plasticity and damage quantities from a continuum perspective that were generated from atomistic results.}, + abstract = {Molecular dynamics simulations using Modified Embedded Atom Method (MEAM) potentials were performed to analyze material length scale influences on damage progression of single crystal nickel. Damage evolution by void growth and coalescence was simulated at very high strain rates (108–1010/s) involving four specimen sizes ranging from ≈5000 to 170,000 atoms with the same initial void volume fraction. 3D rectangular specimens with uniform thickness were provided with one and two embedded cylindrical voids and were subjected to remote uniaxial tension at a constant strain rate. Void volume fraction evolution and the corresponding stress–strain responses were monitored as the voids grew under the increasing applied tractions. The results showed that the specimen length scale changes the dislocation pattern, the evolving void aspect ratio, and the stress–strain response. At small strain levels (0–20\%), a damage evolution size scale effect can be observed from the damage-strain and stress–strain curves, which is consistent with dislocation nucleation argument of Horstemeyer et al. [Horstemeyer, M.F., Baskes, M.I., Plimpton, S.J., 2001a. Length scale and time scale effects on the plastic flow of FCC metals. Acta Mater. 49, pp. 4363–4374] playing a dominant role. However, when the void volume fraction evolution is plotted versus the applied true strain at large plastic strains (\textgreater20\%), minimal size scale differences were observed, even with very different dislocation patterns occurring in the specimen. At this larger strain level, the size scale differences cease to be relevant, because the effects of dislocation nucleation were overcome by dislocation interaction. This study provides fodder for bridging material length scales from the nanoscale to the larger scales by examining plasticity and damage quantities from a continuum perspective that were generated from atomistic results.}, file = {/home/aselimov/docs/My Library/files/680/Potirniche et al. - 2006 - A molecular dynamics study of void growth and coalescence in single crystal nickel.pdf}, issn = {0749-6419} } @@ -2291,13 +3521,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {dec}, volume = {161}, pages = {431--443}, - url = {https://doi.org/10.1016%2Fj.actamat.2018.09.011}, + url = {https://doi.org/10.1016\%2Fj.actamat.2018.09.011}, doi = {10.1016/j.actamat.2018.09.011} } @article{quek_inverse_2016, author = {Quek, Siu Sin and Chooi, Zheng Hoe and Wu, Zhaoxuan and Zhang, Yong Wei and Srolovitz, David J.}, - title = {The inverse hall-petch relation in nanocrystalline metals: {A} discrete dislocation dynamics analysis}, + title = {The inverse hall-petch relation in nanocrystalline metals: A discrete dislocation dynamics analysis}, journal = {Journal of the Mechanics and Physics of Solids}, year = {2016}, volume = {88}, @@ -2310,9 +3540,23 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer keyword = {Grain boundary sliding, Discrete dislocation dynamics, Inverse Hall-Petch, Polycrystals} } +@article{Rafaja_2009, + author = {Rafaja, D. and Schimpf, C. and Klemm, V. and Schreiber, G. and Bakonyi, I. and Péter, L.}, + title = {Formation of microstructural defects in electrodeposited Co/Cu multilayers}, + journal = {Acta Materialia}, + publisher = {Elsevier BV}, + year = {2009}, + month = {jun}, + number = {11}, + volume = {57}, + pages = {3211--3222}, + url = {https://doi.org/10.1016\%2Fj.actamat.2009.03.029}, + doi = {10.1016/j.actamat.2009.03.029} +} + @article{rao_atomistic_2000, author = {Rao, S. I. and Hazzledine, P. M.}, - title = {Atomistic simulations of dislocation–interface interactions in the {Cu}-{Ni} multilayer system}, + title = {Atomistic simulations of dislocation–interface interactions in the Cu-Ni multilayer system}, journal = {Philosophical Magazine A}, year = {2000}, month = {September}, @@ -2329,14 +3573,14 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{rawat_modelling_2002, author = {Rawat, Sunil and Mitra, Nilanjan and Rawat, Sunil and Mitra, Nilanjan}, - title = {Modelling and {Simulation} in {Materials} {Science} and {Engineering} {Related} content {Instability} of hcp structures in modified embedded atom method {Instability} of hcp structures in modified embedded atom method}, + title = {Modelling and Simulation in Materials Science and Engineering Related content Instability of hcp structures in modified embedded atom method Instability of hcp structures in modified embedded atom method}, year = {2002}, file = {/home/aselimov/docs/My Library/files/624/Rawat et al. - 2002 - Modelling and Simulation in Materials Science and Engineering Related content Instability of hcp structures in mod.pdf} } @article{rawat_molecular_2018, author = {Rawat, Sunil and Mitra, Nilanjan}, - title = {Molecular dynamics investigation of c-axis deformation of single crystal {Ti} under uniaxial stress conditions: {Evolution} of compression twinning and dislocations}, + title = {Molecular dynamics investigation of c-axis deformation of single crystal Ti under uniaxial stress conditions: Evolution of compression twinning and dislocations}, journal = {Computational Materials Science}, year = {2018}, volume = {141}, @@ -2348,9 +3592,23 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer keyword = {alpha-Ti, compression twinning, Kim Potential, Molecular Dynamics, phase transformation} } +@article{Ren_2011, + author = {Ren, Fengzhang and Zhao, Shiyang and Li, Wuhui and Tian, Baohong and Yin, Litao and Volinsky, Alex A.}, + title = {Theoretical explanation of Ag/Cu and Cu/Ni nanoscale multilayers softening}, + journal = {Materials Letters}, + publisher = {Elsevier BV}, + year = {2011}, + month = {jan}, + number = {1}, + volume = {65}, + pages = {119--121}, + url = {https://doi.org/10.1016\%2Fj.matlet.2010.09.063}, + doi = {10.1016/j.matlet.2010.09.063} +} + @article{rice_diuision_1967, author = {Rice, J R}, - title = {Diuision of {Engineering} {THE} {APPROXIMATE} {ANALYSIS} {OF} {STRAIN} {CONCENTRATION} {BY} {NOTCHES} {AND} {CRACKS} {Department} of {Defense} {Advanced} {Research} {Projects} {Agency} {Contract} {SD}-86 {Material} {Research} {Progyram} {ARPA} {SD}-86 {REPORT} {E39} {May} 1967}, + title = {Diuision of Engineering THE APPROXIMATE ANALYSIS OF STRAIN CONCENTRATION BY NOTCHES AND CRACKS Department of Defense Advanced Research Projects Agency Contract SD-86 Material Research Progyram ARPA SD-86 REPORT E39 May 1967}, year = {1967}, number = {May}, file = {/home/aselimov/docs/My Library/files/609/Rice - 1967 - A Path Independent Integral and the Approximate Analysis of Strain Concentration by Notches and Cracks(2).pdf} @@ -2358,7 +3616,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{ritchie_mechanisms_1988, author = {Ritchie, R. O.}, - title = {Mechanisms of fatigue crack propagation in metals, ceramics and composites: {Role} of crack tip shielding}, + title = {Mechanisms of fatigue crack propagation in metals, ceramics and composites: Role of crack tip shielding}, journal = {Materials Science and Engineering}, year = {1988}, number = {1}, @@ -2370,9 +3628,56 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer issn = {00255416} } +@article{Robertson_2001, + author = {Robertson, I. M.}, + title = {The effect of hydrogen on dislocation dynamics}, + journal = {Engineering Fracture Mechanics}, + publisher = {Elsevier BV}, + year = {2001}, + month = {apr}, + number = {6}, + volume = {68}, + pages = {671--692}, + url = {https://doi.org/10.1016\%2Fs0013-7944\%2801\%2900011-x}, + doi = {10.1016/s0013-7944(01)00011-x} +} + +@article{ross1994electrodeposited, + author = {Ross, CA}, + title = {Electrodeposited multilayer thin films}, + journal = {Annual Review of Materials Science}, + publisher = {Annual Reviews 4139 El Camino Way, PO Box 10139, Palo Alto, CA 94303-0139, USA}, + year = {1994}, + number = {1}, + volume = {24}, + pages = {159--188} +} + +@article{Roussel_2006, + author = {Roussel, Jean-Marc and Bellon, Pascal}, + title = {Interface sharpening and broadening during annealing ofCu∕Nimultilayers: A kinetic Monte Carlo study}, + journal = {Physical Review B}, + publisher = {American Physical Society (APS)}, + year = {2006}, + month = {feb}, + number = {8}, + volume = {73}, + url = {https://doi.org/10.1103\%2Fphysrevb.73.085403}, + doi = {10.1103/physrevb.73.085403} +} + +@incollection{roy2009electrochemical, + author = {Roy, S}, + title = {Electrochemical fabrication of nanostructured, compositionally modulated metal multilayers (CMMMs)}, + publisher = {Springer}, + year = {2009}, + pages = {349--376}, + booktitle = {Electrochemistry at the Nanoscale} +} + @article{rudd_coarse-grained_2005, author = {Rudd, Robert and Broughton, Jeremy}, - title = {Coarse-grained molecular dynamics: {Nonlinear} finite elements and finite temperature}, + title = {Coarse-grained molecular dynamics: Nonlinear finite elements and finite temperature}, journal = {Physical Review B}, year = {2005}, number = {14}, @@ -2387,13 +3692,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{rudd_concurrent_2000, author = {Rudd, R.E. and Broughton, J.Q.}, - title = {Concurrent {Coupling} of {Length} {Scales} in {Solid} {State} {Systems}}, + title = {Concurrent Coupling of Length Scales in Solid State Systems}, journal = {Physica Status Solidi (B)}, year = {2000}, number = {1}, volume = {217}, pages = {251--291}, - url = {http://doi.wiley.com/10.1002/%28SICI%291521-3951%28200001%29217%3A1%3C251%3A%3AAID-PSSB251%3E3.0.CO%3B2-A}, + url = {http://doi.wiley.com/10.1002/\%28SICI\%291521-3951\%28200001\%29217\%3A1\%3C251\%3A\%3AAID-PSSB251\%3E3.0.CO\%3B2-A}, doi = {10.1002/(SICI)1521-3951(200001)217:1<251::AID-PSSB251>3.0.CO;2-A}, abstract = {A strategic objective of computational materials physics is the accurate description of specific materials on length scales spanning the electronic to the macroscopic. We describe progress towards this goal by reviewing a seamless coupling of quantum to statistical to continuum mechanics, involving two models, implemented via parallel algorithms on supercomputers, for unifying finite elements (FE), molecular dynamics (MD) and semi-empirical tight-binding (TB). The first approach, FE/MD/TB Coupling of Length Scales (FE/MD/TB CLS), consists of a hybrid model in which simulations of the three scales are run concurrently with the minimal coupling that guarantees physical consistency. The second approach, Coarse-Grained Molecular Dynamics (CGMD), introduces an effective model, a scale-dependent generalization of finite elements which passes smoothly into molecular dynamics as the mesh is reduced to atomic spacing. These methodologies are illustrated and validated using the examples of crack propagation in silicon and the dynamics of micro-resonators. We also briefly review a number of other approaches to multiscale modeling.}, file = {/home/aselimov/docs/My Library/files/869/Rudd, Broughton - 2000 - Concurrent Coupling of Length Scales in Solid State Systems(2).pdf}, @@ -2402,7 +3707,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{ruestes_atomistic_2017, author = {Ruestes, Carlos and Alhafez, Iyad and Urbassek, Herbert and Ruestes, Carlos J. and Alhafez, Iyad Alabd and Urbassek, Herbert M.}, - title = {Atomistic {Studies} of {Nanoindentation}— {A} {Review} of {Recent} {Advances}}, + title = {Atomistic Studies of Nanoindentation— A Review of Recent Advances}, journal = {Crystals}, year = {2017}, month = {September}, @@ -2427,10 +3732,24 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {18}, volume = {26}, pages = {2335--2354}, - url = {https://doi.org/10.1557%2Fjmr.2011.275}, + url = {https://doi.org/10.1557\%2Fjmr.2011.275}, doi = {10.1557/jmr.2011.275} } +@article{S_enz_Trevizo_2020, + author = {Sáenz-Trevizo, A and Hodge, A M}, + title = {Nanomaterials by design: a review of nanoscale metallic multilayers}, + journal = {Nanotechnology}, + publisher = {IOP Publishing}, + year = {2020}, + month = {may}, + number = {29}, + volume = {31}, + pages = {292002}, + url = {https://doi.org/10.1088\%2F1361-6528\%2Fab803f}, + doi = {10.1088/1361-6528/ab803f} +} + @article{sadananda_role_2001, author = {Sadananda, K. and Ramaswamy, Dorai Nirmal V.}, title = {Role of crack tip plasticity in fatigue crack growth}, @@ -2440,11 +3759,24 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer volume = {81}, pages = {1283--1303}, doi = {10.1080/01418610108214441}, - abstract = {Abstract The effect of plasticity ahead of the crack tip as well as behind the crack tip (crack wake plasticity) on the crack tip driving force is examined using a dislocation model. The plastic zone is approximated by a superdislocation, and linear elasticity is assumed. Dislocation effects are computed using the Lin?Thomson equations. The error involved in the superdislocation approximation is shown to be small. Results indicate that the plasticity ahead of the crack tip induces a large retarding force which a crack must overcome for it to grow. The existence of a threshold in K max for fatigue crack growth as illustrated by the unified two-parameter approach can be related to this crack growth resistance. The plasticity behind the crack tip. however, has a negligible effect on the crack tip driving force and therefore has no effect on the K max threshold. Overload effects, underload effects and fatigue crack growth resistance with increasing K are all relatable to the internal stresses arising from the dislocations in the plastic zone. The two thresholds K max, th and ?K th in the unified approach can be related to the effects of monotonic and cyclic plastic zones. Since the effects of plasticity in the wake are negligible, plasticity-induced closure due to crack wake plasticity is also negligible from the dislocation point of view. A three-zone approximation for the plastic enclave around crack tip is shown to be adequate for the description of the role of plasticity in the crack tip driving force.\${\textbackslash}backslash\$nAbstract The effect of plasticity ahead of the crack tip as well as behind the crack tip (crack wake plasticity) on the crack tip driving force is examined using a dislocation model. The plastic zone is approximated by a superdislocation, and linear elasticity is assumed. Dislocation effects are computed using the Lin?Thomson equations. The error involved in the superdislocation approximation is shown to be small. Results indicate that the plasticity ahead of the crack tip induces a large retarding force which a crack must overcome for it to grow. The existence of a threshold in K max for fatigue crack growth as illustrated by the unified two-parameter approach can be related to this crack growth resistance. The plasticity behind the crack tip. however, has a negligible effect on the crack tip driving force and therefore has no effect on the K max threshold. Overload effects, underload effects and fatigue crack growth resistance with increasing K are all relatable to the internal stresses arising from the dislocations in the plastic zone. The two thresholds K max, th and ?K th in the unified approach can be related to the effects of monotonic and cyclic plastic zones. Since the effects of plasticity in the wake are negligible, plasticity-induced closure due to crack wake plasticity is also negligible from the dislocation point of view. A three-zone approximation for the plastic enclave around crack tip is shown to be adequate for the description of the role of plasticity in the crack tip driving force.}, + abstract = {Abstract The effect of plasticity ahead of the crack tip as well as behind the crack tip (crack wake plasticity) on the crack tip driving force is examined using a dislocation model. The plastic zone is approximated by a superdislocation, and linear elasticity is assumed. Dislocation effects are computed using the Lin?Thomson equations. The error involved in the superdislocation approximation is shown to be small. Results indicate that the plasticity ahead of the crack tip induces a large retarding force which a crack must overcome for it to grow. The existence of a threshold in K max for fatigue crack growth as illustrated by the unified two-parameter approach can be related to this crack growth resistance. The plasticity behind the crack tip. however, has a negligible effect on the crack tip driving force and therefore has no effect on the K max threshold. Overload effects, underload effects and fatigue crack growth resistance with increasing K are all relatable to the internal stresses arising from the dislocations in the plastic zone. The two thresholds K max, th and ?K th in the unified approach can be related to the effects of monotonic and cyclic plastic zones. Since the effects of plasticity in the wake are negligible, plasticity-induced closure due to crack wake plasticity is also negligible from the dislocation point of view. A three-zone approximation for the plastic enclave around crack tip is shown to be adequate for the description of the role of plasticity in the crack tip driving force.\$\backslash\$nAbstract The effect of plasticity ahead of the crack tip as well as behind the crack tip (crack wake plasticity) on the crack tip driving force is examined using a dislocation model. The plastic zone is approximated by a superdislocation, and linear elasticity is assumed. Dislocation effects are computed using the Lin?Thomson equations. The error involved in the superdislocation approximation is shown to be small. Results indicate that the plasticity ahead of the crack tip induces a large retarding force which a crack must overcome for it to grow. The existence of a threshold in K max for fatigue crack growth as illustrated by the unified two-parameter approach can be related to this crack growth resistance. The plasticity behind the crack tip. however, has a negligible effect on the crack tip driving force and therefore has no effect on the K max threshold. Overload effects, underload effects and fatigue crack growth resistance with increasing K are all relatable to the internal stresses arising from the dislocations in the plastic zone. The two thresholds K max, th and ?K th in the unified approach can be related to the effects of monotonic and cyclic plastic zones. Since the effects of plasticity in the wake are negligible, plasticity-induced closure due to crack wake plasticity is also negligible from the dislocation point of view. A three-zone approximation for the plastic enclave around crack tip is shown to be adequate for the description of the role of plasticity in the crack tip driving force.}, file = {/home/aselimov/docs/My Library/files/717/Sadananda, Ramaswamy - 2001 - Role of crack tip plasticity in fatigue crack growth(2).pdf}, issn = {01418610} } +@article{Sadigh_2012, + author = {Sadigh, Babak and Erhart, Paul and Stukowski, Alexander and Caro, Alfredo and Martinez, Enrique and Zepeda-Ruiz, Luis}, + title = {Scalable parallel Monte Carlo algorithm for atomistic simulations of precipitation in alloys}, + journal = {Physical Review B}, + publisher = {American Physical Society (APS)}, + year = {2012}, + month = {may}, + number = {18}, + volume = {85}, + url = {https://doi.org/10.1103\%2Fphysrevb.85.184203}, + doi = {10.1103/physrevb.85.184203} +} + @article{Saito_1999, author = {Saito, Y. and Utsunomiya, H. and Tsuji, N. and Sakai, T.}, title = {Novel ultra-high straining process for bulk materials—development of the accumulative roll-bonding (ARB) process}, @@ -2455,7 +3787,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {2}, volume = {47}, pages = {579--583}, - url = {https://doi.org/10.1016%2Fs1359-6454%2898%2900365-6}, + url = {https://doi.org/10.1016\%2Fs1359-6454\%2898\%2900365-6}, doi = {10.1016/s1359-6454(98)00365-6} } @@ -2469,7 +3801,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {1}, volume = {59}, pages = {283--296}, - url = {https://doi.org/10.1016%2Fj.actamat.2010.09.032}, + url = {https://doi.org/10.1016\%2Fj.actamat.2010.09.032}, doi = {10.1016/j.actamat.2010.09.032} } @@ -2482,13 +3814,25 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {apr}, volume = {542}, pages = {21--30}, - url = {https://doi.org/10.1016%2Fj.msea.2012.02.023}, + url = {https://doi.org/10.1016\%2Fj.msea.2012.02.023}, doi = {10.1016/j.msea.2012.02.023} } +@article{Santos_G_emes_2021, + author = {Santos-Güemes, R. and Capolungo, L. and Segurado, J. and LLorca, J.}, + title = {Dislocation dynamics prediction of the strength of Al-Cu alloys containing shearable θ$\prime$$\prime$ precipitates}, + journal = {Journal of the Mechanics and Physics of Solids}, + publisher = {Elsevier BV}, + year = {2021}, + month = {mar}, + pages = {104375}, + url = {https://doi.org/10.1016\%2Fj.jmps.2021.104375}, + doi = {10.1016/j.jmps.2021.104375} +} + @article{schiotz_maximum_2003, author = {Schiotz, Jakob and Jacobsen, Karsten}, - title = {A {Maximum} in the {Strength} of {Nanocrystalline} {Copper}}, + title = {A Maximum in the Strength of Nanocrystalline Copper}, journal = {Science (New York, N.Y.)}, year = {2003}, month = {April}, @@ -2504,7 +3848,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{schuh_hall-petch_2002, author = {Schuh, C. A. and Nieh, T. G. and Yamasaki, T.}, - title = {Hall-{Petch} breakdown manifested in abrasive wear resistance of nanocrystalline nickel}, + title = {Hall-Petch breakdown manifested in abrasive wear resistance of nanocrystalline nickel}, journal = {Scripta Materialia}, year = {2002}, number = {10}, @@ -2516,18 +3860,15 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer keyword = {inverse hall-petch, NC, Indentation, Nanocrystalline nickel, Wear} } -@article{S_enz_Trevizo_2020, - author = {Sáenz-Trevizo, A and Hodge, A M}, - title = {Nanomaterials by design: a review of nanoscale metallic multilayers}, - journal = {Nanotechnology}, - publisher = {IOP Publishing}, - year = {2020}, - month = {may}, - number = {29}, - volume = {31}, - pages = {292002}, - url = {https://doi.org/10.1088%2F1361-6528%2Fab803f}, - doi = {10.1088/1361-6528/ab803f} +@article{Selimov_2021, + author = {Selimov, Alex and Xu, Shuozhi and Chen, Youping and McDowell, David}, + title = {Lattice dislocation induced misfit dislocation evolution in semi-coherent $111$ bimetal interfaces}, + journal = {Journal of Materials Research}, + publisher = {Springer Science and Business Media LLC}, + year = {2021}, + month = {apr}, + url = {https://doi.org/10.1557\%2Fs43578-021-00184-8}, + doi = {10.1557/s43578-021-00184-8} } @article{Shao_2010, @@ -2540,23 +3881,10 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {5}, volume = {18}, pages = {055010}, - url = {https://doi.org/10.1088%2F0965-0393%2F18%2F5%2F055010}, + url = {https://doi.org/10.1088\%2F0965-0393\%2F18\%2F5\%2F055010}, doi = {10.1088/0965-0393/18/5/055010} } -@article{Shao_2013a, - author = {Shao, S. and Zbib, H. M. and Mastorakos, I. and Bahr, D. F.}, - title = {Effect of Interfaces in the Work Hardening of Nanoscale Multilayer Metallic Composites During Nanoindentation: A Molecular Dynamics Investigation}, - journal = {Journal of Engineering Materials and Technology}, - publisher = {ASME International}, - year = {2013}, - month = {mar}, - number = {2}, - volume = {135}, - url = {https://doi.org/10.1115%2F1.4023672}, - doi = {10.1115/1.4023672} -} - @article{Shao_2013, author = {Shao, Shuai and Wang, Jian and Misra, Amit and Hoagland, Richard G.}, title = {Spiral Patterns of Dislocations at Nodes in (111) Semi-coherent FCC Interfaces}, @@ -2566,10 +3894,23 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {aug}, number = {1}, volume = {3}, - url = {https://doi.org/10.1038%2Fsrep02448}, + url = {https://doi.org/10.1038\%2Fsrep02448}, doi = {10.1038/srep02448} } +@article{Shao_2013a, + author = {Shao, S. and Zbib, H. M. and Mastorakos, I. and Bahr, D. F.}, + title = {Effect of Interfaces in the Work Hardening of Nanoscale Multilayer Metallic Composites During Nanoindentation: A Molecular Dynamics Investigation}, + journal = {Journal of Engineering Materials and Technology}, + publisher = {ASME International}, + year = {2013}, + month = {mar}, + number = {2}, + volume = {135}, + url = {https://doi.org/10.1115\%2F1.4023672}, + doi = {10.1115/1.4023672} +} + @article{Shao_2014, author = {Shao, Shuai and Wang, J. and Misra, Amit}, title = {Energy minimization mechanisms of semi-coherent interfaces}, @@ -2580,13 +3921,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {2}, volume = {116}, pages = {023508}, - url = {https://doi.org/10.1063%2F1.4889927}, + url = {https://doi.org/10.1063\%2F1.4889927}, doi = {10.1063/1.4889927} } @article{Shao_2015, author = {Shao, Shuai and Wang, Jian and Beyerlein, Irene J. and Misra, Amit}, - title = {Glide dislocation nucleation from dislocation nodes at semi-coherent \{1 1 1\} {Cu}–{Ni} interfaces}, + title = {Glide dislocation nucleation from dislocation nodes at semi-coherent \1 1 1\ Cu-Ni interfaces}, journal = {Acta Materialia}, publisher = {Elsevier BV}, year = {2015}, @@ -2603,7 +3944,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer publisher = {Springer International Publishing}, year = {2020}, pages = {1049--1078}, - url = {https://doi.org/10.1007%2F978-3-319-44677-6_86}, + url = {https://doi.org/10.1007\%2F978-3-319-44677-6_86}, doi = {10.1007/978-3-319-44677-6_86}, booktitle = {Handbook of Materials Modeling} } @@ -2618,7 +3959,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {14}, volume = {87}, pages = {141906}, - url = {https://doi.org/10.1063%2F1.2056610}, + url = {https://doi.org/10.1063\%2F1.2056610}, doi = {10.1063/1.2056610} } @@ -2639,13 +3980,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{shewchuk_introduction_1994, author = {Shewchuk, Jonathan Richard}, - title = {An {Introduction} to the {Conjugate} {Gradient} {Method} {Without} the {Agonizing} {Pain}}, + title = {An Introduction to the Conjugate Gradient Method Without the Agonizing Pain}, journal = {Science}, year = {1994}, number = {CS-94-125}, volume = {49}, pages = {64}, - url = {http://citeseerx.ist.psu.edu/viewdoc/download?doi=10.1.1.110.418&rep=rep1&type=pdf%5Cnhttp://www.cs.cmu.edu/ quake-papers/painless-conjugate-gradient.pdf}, + url = {http://citeseerx.ist.psu.edu/viewdoc/download?doi=10.1.1.110.418\&rep=rep1\&type=pdf\%5Cnhttp://www.cs.cmu.edu/ quake-papers/painless-conjugate-gradient.pdf}, doi = {10.1.1.110.418}, abstract = {The Conjugate Gradient Method is the most prominent iterative method for solving sparse systems of linear equations. Unfortunately, many textbook treatments of the topic are written with neither illustrations nor intuition, and their victims can be found to this day babbling senselessly in the corners of dusty libraries. For this reason, a deep, geometric understanding of the method has been reserved for the elite brilliant few who have painstakingly decoded the mumblings of their forebears. Nevertheless, the Conjugate Gradient Method is a composite of simple, elegant ideas that almost anyone can understand. Of course, a reader as intelligent as yourself will learn them almost effortlessly. The idea of quadratic forms is introduced and used to derive the methods of Steepest Descent, Conjugate Directions, and Conjugate Gradients. Eigenvectors are explained and used to examine the convergence of the Jacobi Method, Steepest Descent, and Conjugate Gradients. Other topics include preconditioning and the nonlinear Conjugate Gradient Method. I have taken pains to make this article easy to read. Sixty-six illustrations are provided. Dense prose is avoided. Concepts are explained in several differentways. Most equations are coupled with an intuitive interpretation.}, file = {/home/aselimov/docs/My Library/files/692/painless-conjugate-gradient.pdf}, @@ -2663,7 +4004,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {jun}, number = {2}, volume = {89}, - url = {https://doi.org/10.1103%2Fphysrevlett.89.025501}, + url = {https://doi.org/10.1103\%2Fphysrevlett.89.025501}, doi = {10.1103/physrevlett.89.025501} } @@ -2676,10 +4017,24 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {apr}, number = {14}, volume = {75}, - url = {https://doi.org/10.1103%2Fphysrevb.75.144108}, + url = {https://doi.org/10.1103\%2Fphysrevb.75.144108}, doi = {10.1103/physrevb.75.144108} } +@article{Shin_2003, + author = {Shin, C. S. and Fivel¶, M. C. and Verdier, M. and Oh, K. H.}, + title = {Dislocation–impenetrable precipitate interaction: a three-dimensional discrete dislocation dynamics analysis}, + journal = {Philosophical Magazine}, + publisher = {Informa UK Limited}, + year = {2003}, + month = {oct}, + number = {31-34}, + volume = {83}, + pages = {3691--3704}, + url = {https://doi.org/10.1080\%2F14786430310001599379}, + doi = {10.1080/14786430310001599379} +} + @article{Shinoda_2004, author = {Shinoda, Wataru and Shiga, Motoyuki and Mikami, Masuhiro}, title = {Rapid estimation of elastic constants by molecular dynamics simulation under constant stress}, @@ -2689,10 +4044,37 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {apr}, number = {13}, volume = {69}, - url = {https://doi.org/10.1103%2Fphysrevb.69.134103}, + url = {https://doi.org/10.1103\%2Fphysrevb.69.134103}, doi = {10.1103/physrevb.69.134103} } +@article{Sills_2020, + author = {Sills, Ryan B. and Foster, Michael E. and Zhou, Xiaowang W.}, + title = {Line-length-dependent dislocation mobilities in an FCC stainless steel alloy}, + journal = {International Journal of Plasticity}, + publisher = {Elsevier BV}, + year = {2020}, + month = {dec}, + volume = {135}, + pages = {102791}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2020.102791}, + doi = {10.1016/j.ijplas.2020.102791} +} + +@article{Singh_2009, + author = {Singh, Surendra and Basu, Saibal and Ghosh, S. K.}, + title = {Structure and morphology of Cu/Ni film grown by electrodeposition method: A study of neutron reflectivity and AFM}, + journal = {Applied Surface Science}, + publisher = {Elsevier BV}, + year = {2009}, + month = {mar}, + number = {11}, + volume = {255}, + pages = {5910--5916}, + url = {https://doi.org/10.1016\%2Fj.apsusc.2009.01.030}, + doi = {10.1016/j.apsusc.2009.01.030} +} + @article{smirnov_introduction_2008, author = {Smirnov, Draft A V}, title = {An introduction to tensor calculus, relativity, and cosmology}, @@ -2718,13 +4100,24 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {11}, volume = {69}, pages = {2214--2226}, - url = {https://doi.org/10.1007%2Fs11837-017-2533-1}, + url = {https://doi.org/10.1007\%2Fs11837-017-2533-1}, doi = {10.1007/s11837-017-2533-1} } +@incollection{Sobha_Jayakrishnan_2012, + author = {Jayakrishnan, D. Sobha}, + title = {Electrodeposition: the versatile technique for nanomaterials}, + publisher = {Elsevier}, + year = {2012}, + pages = {86--125}, + url = {https://doi.org/10.1533\%2F9780857095800.1.86}, + doi = {10.1533/9780857095800.1.86}, + booktitle = {Corrosion Protection and Control Using Nanomaterials} +} + @article{sobie_modal_2017, author = {Sobie, Cameron and Capolungo, Laurent and McDowell, David L. and Martinez, Enrique}, - title = {Modal {Analysis} of {Dislocation} {Vibration} and {Reaction} {Attempt} {Frequency}}, + title = {Modal Analysis of Dislocation Vibration and Reaction Attempt Frequency}, journal = {Acta Materialia}, year = {2017}, volume = {134}, @@ -2770,13 +4163,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {apr}, volume = {68}, pages = {61--69}, - url = {https://doi.org/10.1016%2Fj.actamat.2014.01.008}, + url = {https://doi.org/10.1016\%2Fj.actamat.2014.01.008}, doi = {10.1016/j.actamat.2014.01.008} } @article{streitz_surface-stress_1994, author = {Streitz, F. H. and Cammarata, R. C. and Sieradzki, K.}, - title = {Surface-stress effects on elastic properties. {II}. {Metallic} multilayers}, + title = {Surface-stress effects on elastic properties. II. Metallic multilayers}, journal = {Physical Review B}, year = {1994}, month = {April}, @@ -2791,7 +4184,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{stueber_concepts_2009, author = {Stueber, M. and Holleck, H. and Leiste, H. and Seemann, K. and Ulrich, S. and Ziebert, C.}, - title = {Concepts for the design of advanced nanoscale {PVD} multilayer protective thin films}, + title = {Concepts for the design of advanced nanoscale PVD multilayer protective thin films}, journal = {Journal of Alloys and Compounds}, year = {2009}, month = {August}, @@ -2816,7 +4209,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {1}, volume = {18}, pages = {015012}, - url = {https://doi.org/10.1088%2F0965-0393%2F18%2F1%2F015012}, + url = {https://doi.org/10.1088\%2F0965-0393\%2F18\%2F1\%2F015012}, doi = {10.1088/0965-0393/18/1/015012} } @@ -2925,7 +4318,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pages = {4340--4346}, url = {https://www.sciencedirect.com/science/article/pii/S0020768308001248}, doi = {10.1016/J.IJSOLSTR.2008.03.016}, - abstract = {The equivalence of the virial stress and Cauchy stress is reviewed using both theoretical arguments and numerical simulations. Using thermoelasticity problems as examples, we numerically demonstrate that virial stress is equivalent to the continuum Cauchy stress. Neglecting the velocity terms in the definition of virial stress as many authors have recently suggested, can cause significant errors in interpreting MD simulation results at elevated temperatures (T{\textbackslash}textgreater0K).}, + abstract = {The equivalence of the virial stress and Cauchy stress is reviewed using both theoretical arguments and numerical simulations. Using thermoelasticity problems as examples, we numerically demonstrate that virial stress is equivalent to the continuum Cauchy stress. Neglecting the velocity terms in the definition of virial stress as many authors have recently suggested, can cause significant errors in interpreting MD simulation results at elevated temperatures (T\textgreater0K).}, file = {/home/aselimov/docs/My Library/files/661/Subramaniyan, Sun - 2008 - Continuum interpretation of virial stress in molecular simulations.pdf}, issn = {0020-7683} } @@ -2939,10 +4332,24 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {apr}, volume = {819}, pages = {152956}, - url = {https://doi.org/10.1016%2Fj.jallcom.2019.152956}, + url = {https://doi.org/10.1016\%2Fj.jallcom.2019.152956}, doi = {10.1016/j.jallcom.2019.152956} } +@article{Sun_2021, + author = {Sun, Jiaqi and Li, Yang and Karaaslan, Yenal and Sevik, Cem and Chen, Youping}, + title = {Misfit dislocation structure and thermal boundary conductance of GaN/AlN interfaces}, + journal = {Journal of Applied Physics}, + publisher = {AIP Publishing}, + year = {2021}, + month = {jul}, + number = {3}, + volume = {130}, + pages = {035301}, + url = {https://doi.org/10.1063\%2F5.0049662}, + doi = {10.1063/5.0049662} +} + @article{sun_disconnections_2018, author = {Sun, X. Y. and Fressengeas, C. and Taupin, V. and Cordier, P. and Combe, N.}, title = {Disconnections, dislocations and generalized disclinations in grain boundary ledges}, @@ -2957,6 +4364,15 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer issn = {07496419} } +@book{tadmor2011modeling, + author = {Tadmor, Ellad}, + title = {Modeling materials : continuum, atomistic, and multiscale techniques}, + publisher = {Cambridge University Press}, + year = {2011}, + address = {Cambridge New York}, + isbn = {0521856981} +} + @article{Tadmor_1996, author = {Tadmor, E. B. and Ortiz, M. and Phillips, R.}, title = {Quasicontinuum analysis of defects in solids}, @@ -2967,19 +4383,10 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {6}, volume = {73}, pages = {1529--1563}, - url = {https://doi.org/10.1080%2F01418619608243000}, + url = {https://doi.org/10.1080\%2F01418619608243000}, doi = {10.1080/01418619608243000} } -@book{tadmor2011modeling, - author = {Tadmor, Ellad}, - title = {Modeling materials : continuum, atomistic, and multiscale techniques}, - publisher = {Cambridge University Press}, - year = {2011}, - address = {Cambridge New York}, - isbn = {0521856981} -} - @article{Tadmor_2013, author = {Tadmor, E. B. and Legoll, F. and Kim, W. K. and Dupuy, L. M. and Miller, R. E.}, title = {Finite-Temperature Quasi-Continuum}, @@ -2989,13 +4396,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {jan}, number = {1}, volume = {65}, - url = {https://doi.org/10.1115%2F1.4023013}, + url = {https://doi.org/10.1115\%2F1.4023013}, doi = {10.1115/1.4023013} } @article{tallman_reconciled_2017, author = {Tallman, Aaron E. and Swiler, Laura P. and Wang, Yan and McDowell, David L.}, - title = {Reconciled top-down and bottom-up hierarchical multiscale calibration of bcc {Fe} crystal plasticity}, + title = {Reconciled top-down and bottom-up hierarchical multiscale calibration of bcc Fe crystal plasticity}, journal = {International Journal for Multiscale Computational Engineering}, year = {2017}, number = {6}, @@ -3018,6 +4425,19 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pages = {391--431} } +@article{Tawfeeq_2019, + author = {Tawfeeq, Maisaa N. and Klassen, Robert J.}, + title = {Effect of ion implantation on the grain boundary strength of heat treated Inconel X750}, + journal = {Journal of Nuclear Materials}, + publisher = {Elsevier BV}, + year = {2019}, + month = {apr}, + volume = {516}, + pages = {255--263}, + url = {https://doi.org/10.1016\%2Fj.jnucmat.2019.01.013}, + doi = {10.1016/j.jnucmat.2019.01.013} +} + @article{Tehranchi_2016, author = {Tehranchi, A and Zhang, X and Lu, G and Curtin, W A}, title = {Hydrogen–vacancy–dislocation interactions in$p̆alpha$-Fe}, @@ -3028,13 +4448,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {2}, volume = {25}, pages = {025001}, - url = {https://doi.org/10.1088%2F1361-651x%2Faa52cb}, + url = {https://doi.org/10.1088\%2F1361-651x\%2Faa52cb}, doi = {10.1088/1361-651x/aa52cb} } @article{tench_tensile_1991, author = {Tench, D. M. and White, J. T.}, - title = {Tensile {Properties} of {Nanostructured} {Ni}-{Cu} {Multilayered} {Materials} {Prepared} by {Electrodeposition}}, + title = {Tensile Properties of Nanostructured Ni-Cu Multilayered Materials Prepared by Electrodeposition}, journal = {Journal of The Electrochemical Society}, year = {1991}, month = {December}, @@ -3047,16 +4467,44 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer issn = {00134651} } +@article{Terentyev_2013, + author = {Terentyev, D. and Monnet, G. and Grigorev, P.}, + title = {Transfer of molecular dynamics data to dislocation dynamics to assess dislocation–dislocation loop interaction in iron}, + journal = {Scripta Materialia}, + publisher = {Elsevier BV}, + year = {2013}, + month = {oct}, + number = {8}, + volume = {69}, + pages = {578--581}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2013.06.026}, + doi = {10.1016/j.scriptamat.2013.06.026} +} + +@article{Tian_2017, + author = {Tian, Yuan-Yuan and Li, Jia and Hu, Ze-Ying and Wang, Zhi-Peng and Fang, Qi-Hong}, + title = {Molecular dynamics study of plastic deformation mechanism in Cu/Ag multilayers}, + journal = {Chinese Physics B}, + publisher = {IOP Publishing}, + year = {2017}, + month = {dec}, + number = {12}, + volume = {26}, + pages = {126802}, + url = {https://doi.org/10.1088\%2F1674-1056\%2F26\%2F12\%2F126802}, + doi = {10.1088/1674-1056/26/12/126802} +} + @article{Tian_2020, author = {Tian, Xia and Cui, Junzhi and Yang, Mei and Ma, Kaipeng and Xiang, Meizhen}, - title = {Molecular dynamics simulations on shock response and spalling behaviors of semi-coherent \{111\} {C}u-{A}l multilayers}, + title = {Molecular dynamics simulations on shock response and spalling behaviors of semi-coherent \111\ Cu-Al multilayers}, journal = {International Journal of Mechanical Sciences}, publisher = {Elsevier BV}, year = {2020}, month = {apr}, volume = {172}, pages = {105414}, - url = {https://doi.org/10.1016%2Fj.ijmecsci.2019.105414}, + url = {https://doi.org/10.1016\%2Fj.ijmecsci.2019.105414}, doi = {10.1016/j.ijmecsci.2019.105414} } @@ -3069,15 +4517,29 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {jul}, volume = {366}, pages = {113075}, - url = {https://doi.org/10.1016%2Fj.cma.2020.113075}, + url = {https://doi.org/10.1016\%2Fj.cma.2020.113075}, doi = {10.1016/j.cma.2020.113075} } +@article{Tschopp_2015, + author = {Tschopp, Mark A. and Coleman, Shawn P. and McDowell, David L.}, + title = {Symmetric and asymmetric tilt grain boundary structure and energy in Cu and Al (and transferability to other fcc metals)}, + journal = {Integrating Materials and Manufacturing Innovation}, + publisher = {Springer Science and Business Media LLC}, + year = {2015}, + month = {oct}, + number = {1}, + volume = {4}, + pages = {176--189}, + url = {https://doi.org/10.1186\%2Fs40192-015-0040-1}, + doi = {10.1186/s40192-015-0040-1} +} + @phdthesis{tschopp_atomistic_2007, author = {Tschopp, Mark A.}, - title = {Atomistic {Simulations} of {Dislocation} {Nucleation} in {Single} {Crystals} and {Grain} {Boundaries} {Atomistic} {Simulations} of {Dislocation} {Nucleation}}, + title = {Atomistic Simulations of Dislocation Nucleation in Single Crystals and Grain Boundaries Atomistic Simulations of Dislocation Nucleation}, year = {2007}, - abstract = {The objective of this research is to use atomistic simulations to investigate dislocation nucleation from grain boundaries in face-centered cubic aluminum and copper. This research primarily focuses on asymmetric tilt grain boundaries and has three main components. First, this research uses molecular statics simulations of the structure and energy of these faceted, dissociated grain boundary structures to show that {\textbackslash}pounds3 asymmetric boundaries can be decomposed into the structural units of the {\textbackslash}pounds3 symmetric tilt grain boundaries, i.e., the coherent and incoherent twin boundaries. Moreover, the energy for all {\textbackslash}pounds3 asymmetric boundaries is predicted with only the energies of the {\textbackslash}pounds3 symmetric boundaries and the inclination angle. Understanding the structure of these boundaries provides insight into dislocation nucleation from these boundaries. Further work into the structure and energy of other low order {\textbackslash}pounds asymmetric boundaries and the spatial distribution of free volume within the grain boundaries also provides insight into dislocation nucleation mechanisms. Second, this research uses molecular dynamics deformation simulations with uniaxial tension applied perpendicular to these boundaries to show that the dislocation nucleation mechanisms in asymmetric boundaries are highly dependent on the faceted, dissociated structure. Grain boundary dislocation sources can act as perfect sources/sinks for dislocations or may violate this premise by increasing the dislocation content of the boundary during nucleation. Furthermore, simulations under uniaxial tension and uniaxial compression show that nucleation of the second partial dislocation in copper exhibits tension-compression asymmetry. Third, this research explores the development of models that incorporate the resolved stress components on the slip system of dislocation nucleation to predict the atomic stress required for dislocation nucleation from single crystals and grain boundaries. Single crystal simulations of homogeneous dislocation nucleation help define the role of lattice orientation on the nucleation stress for grain boundaries. The resolved stress normal to the slip plane on which the dislocation nucleates plays an integral role in the dislocation nucleation stress and related mechanisms. In summary, the synthesis of various aspects of this work has provided improved understanding of how the grain boundary character influences dislocation nucleation in bicrystals, with possible implications for nanocrystalline materials.}, + abstract = {The objective of this research is to use atomistic simulations to investigate dislocation nucleation from grain boundaries in face-centered cubic aluminum and copper. This research primarily focuses on asymmetric tilt grain boundaries and has three main components. First, this research uses molecular statics simulations of the structure and energy of these faceted, dissociated grain boundary structures to show that \pounds3 asymmetric boundaries can be decomposed into the structural units of the \pounds3 symmetric tilt grain boundaries, i.e., the coherent and incoherent twin boundaries. Moreover, the energy for all \pounds3 asymmetric boundaries is predicted with only the energies of the \pounds3 symmetric boundaries and the inclination angle. Understanding the structure of these boundaries provides insight into dislocation nucleation from these boundaries. Further work into the structure and energy of other low order \pounds asymmetric boundaries and the spatial distribution of free volume within the grain boundaries also provides insight into dislocation nucleation mechanisms. Second, this research uses molecular dynamics deformation simulations with uniaxial tension applied perpendicular to these boundaries to show that the dislocation nucleation mechanisms in asymmetric boundaries are highly dependent on the faceted, dissociated structure. Grain boundary dislocation sources can act as perfect sources/sinks for dislocations or may violate this premise by increasing the dislocation content of the boundary during nucleation. Furthermore, simulations under uniaxial tension and uniaxial compression show that nucleation of the second partial dislocation in copper exhibits tension-compression asymmetry. Third, this research explores the development of models that incorporate the resolved stress components on the slip system of dislocation nucleation to predict the atomic stress required for dislocation nucleation from single crystals and grain boundaries. Single crystal simulations of homogeneous dislocation nucleation help define the role of lattice orientation on the nucleation stress for grain boundaries. The resolved stress normal to the slip plane on which the dislocation nucleates plays an integral role in the dislocation nucleation stress and related mechanisms. In summary, the synthesis of various aspects of this work has provided improved understanding of how the grain boundary character influences dislocation nucleation in bicrystals, with possible implications for nanocrystalline materials.}, file = {/home/aselimov/docs/My Library/files/618/Tschopp - 2007 - Atomistic Simulations of Dislocation Nucleation in Single Crystals and Grain Boundaries Atomistic Simulations of Dis(3).pdf}, school = {Georgia Institute of Technology} } @@ -3093,11 +4555,18 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pages = {351--362}, url = {https://www.sciencedirect.com/science/article/pii/S0927025608001870}, doi = {10.1016/J.COMMATSCI.2008.03.041}, - abstract = {Atomistic simulations are used to investigate how grain boundary structure influences dislocation nucleation under uniaxial tension and compression for a specific class of symmetric tilt grain boundaries that contain the E structural unit. After obtaining the minimum energy grain boundary structure, molecular dynamics was employed based on an embedded-atom method potential for copper at 10K. Results show several differences in dislocation nucleation with respect to uniaxial tension and compression. First, the average nucleation stress for all 〈110〉 symmetric tilt grain boundaries is over three times greater in compression than in tension for both the high strain rate and quasistatic simulations. Second, partial dislocations nucleate from the boundary on the \{111\} slip plane under uniaxial tension. However, partial and full dislocations nucleate from the boundary on the \{100\} and \{111\} slip planes under uniaxial compression. The full dislocation nucleation on the \{100\} plane for boundaries with misorientations near the coherent twin boundary is explained through the higher resolved shear stress on the \{100\} plane compared to the \{111\} plane. Last, individual dislocation nucleation mechanisms under uniaxial tension and compression are analyzed. For the vicinal twin boundary under tension, the grain boundary partial dislocation is emitted into the lattice on the same \{111\} plane that it dissociated onto. For compression of the vicinal twin, the 1/3〈111 〉 disconnection is removed through full dislocation emission on the \{100\} plane and partial dislocation emission parallel to the coherent twin boundary plane, restoring the boundary to the coherent twin. For the Σ19 boundary, the nearly simultaneous emission of numerous partial dislocations from the boundary result in the formation of the hexagonal close-packed (HCP) phase.}, + abstract = {Atomistic simulations are used to investigate how grain boundary structure influences dislocation nucleation under uniaxial tension and compression for a specific class of symmetric tilt grain boundaries that contain the E structural unit. After obtaining the minimum energy grain boundary structure, molecular dynamics was employed based on an embedded-atom method potential for copper at 10K. Results show several differences in dislocation nucleation with respect to uniaxial tension and compression. First, the average nucleation stress for all 〈110〉 symmetric tilt grain boundaries is over three times greater in compression than in tension for both the high strain rate and quasistatic simulations. Second, partial dislocations nucleate from the boundary on the \111\ slip plane under uniaxial tension. However, partial and full dislocations nucleate from the boundary on the \100\ and \111\ slip planes under uniaxial compression. The full dislocation nucleation on the \100\ plane for boundaries with misorientations near the coherent twin boundary is explained through the higher resolved shear stress on the \100\ plane compared to the \111\ plane. Last, individual dislocation nucleation mechanisms under uniaxial tension and compression are analyzed. For the vicinal twin boundary under tension, the grain boundary partial dislocation is emitted into the lattice on the same \111\ plane that it dissociated onto. For compression of the vicinal twin, the 1/3〈111 〉 disconnection is removed through full dislocation emission on the \100\ plane and partial dislocation emission parallel to the coherent twin boundary plane, restoring the boundary to the coherent twin. For the $Σ$19 boundary, the nearly simultaneous emission of numerous partial dislocations from the boundary result in the formation of the hexagonal close-packed (HCP) phase.}, file = {/home/aselimov/docs/My Library/files/629/Tschopp, Tucker, McDowell - 2008 - Atomistic simulations of tension–compression asymmetry in dislocation nucleation for copper grain b.pdf}, issn = {0927-0256} } +@phdthesis{tucker2011atomistic, + author = {Tucker, Garritt J}, + title = {Atomistic simulations of defect nucleation and free volume in nanocrystalline materials}, + year = {2011}, + school = {Georgia Institute of Technology} +} + @article{Tucker_2009, author = {Tucker, G J and Zimmerman, J A and McDowell, D L}, title = {Shear deformation kinematics of bicrystalline grain boundaries in atomistic simulations}, @@ -3108,17 +4577,10 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {1}, volume = {18}, pages = {015002}, - url = {https://doi.org/10.1088%2F0965-0393%2F18%2F1%2F015002}, + url = {https://doi.org/10.1088\%2F0965-0393\%2F18\%2F1\%2F015002}, doi = {10.1088/0965-0393/18/1/015002} } -@phdthesis{tucker2011atomistic, - author = {Tucker, Garritt J}, - title = {Atomistic simulations of defect nucleation and free volume in nanocrystalline materials}, - year = {2011}, - school = {Georgia Institute of Technology} -} - @article{Tucker_2011, author = {Tucker, Garritt J. and Zimmerman, Jonathan A. and McDowell, David L.}, title = {Continuum metrics for deformation and microrotation from atomistic simulations: Application to grain boundaries}, @@ -3129,7 +4591,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {12}, volume = {49}, pages = {1424--1434}, - url = {https://doi.org/10.1016%2Fj.ijengsci.2011.03.019}, + url = {https://doi.org/10.1016\%2Fj.ijengsci.2011.03.019}, doi = {10.1016/j.ijengsci.2011.03.019} } @@ -3142,10 +4604,21 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {jun}, volume = {151}, pages = {100--111}, - url = {https://doi.org/10.1016%2Fj.actamat.2018.03.055}, + url = {https://doi.org/10.1016\%2Fj.actamat.2018.03.055}, doi = {10.1016/j.actamat.2018.03.055} } +@article{varvenne2016average, + author = {Varvenne, Céline and Luque, Aitor and Nöhring, Wolfram G and Curtin, William A}, + title = {Average-atom interatomic potential for random alloys}, + journal = {Physical Review B}, + publisher = {APS}, + year = {2016}, + number = {10}, + volume = {93}, + pages = {104201} +} + @article{Varvenne_2017, author = {Varvenne, C. and Leyson, G. P. M. and Ghazisaeidi, M. and Curtin, W. A.}, title = {Solute strengthening in random alloys}, @@ -3155,10 +4628,18 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {feb}, volume = {124}, pages = {660--683}, - url = {https://doi.org/10.1016%2Fj.actamat.2016.09.046}, + url = {https://doi.org/10.1016\%2Fj.actamat.2016.09.046}, doi = {10.1016/j.actamat.2016.09.046} } +@article{verdier2001some, + author = {Verdier, M and Gilles, B and Fivel, M}, + title = {Some investigations on the effect of layer thickness in multilayer metal composites on mechanical properties}, + journal = {Advanced Engineering Materials}, + year = {2001}, + volume = {3} +} + @article{Vineyard_1957, author = {Vineyard, George H.}, title = {Frequency factors and isotope effects in solid state rate processes}, @@ -3169,7 +4650,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {1-2}, volume = {3}, pages = {121--127}, - url = {https://doi.org/10.1016%2F0022-3697%2857%2990059-8}, + url = {https://doi.org/10.1016\%2F0022-3697\%2857\%2990059-8}, doi = {10.1016/0022-3697(57)90059-8} } @@ -3183,13 +4664,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {11}, volume = {80}, pages = {5832--5838}, - url = {https://doi.org/10.1063%2F1.446610}, + url = {https://doi.org/10.1063\%2F1.446610}, doi = {10.1063/1.446610} } @article{voter_accurate_1986, author = {Voter, Arthur F and Chen, Shao Ping}, - title = {Accurate interatomic potentials for {Ni}, {Al}, and {Ni3Al}}, + title = {Accurate interatomic potentials for Ni, Al, and Ni3Al}, journal = {MRS Online Proceedings Library Archive}, year = {1986}, volume = {82}, @@ -3198,6 +4679,17 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer file = {/home/aselimov/docs/My Library/files/853/Voter, Chen - 1986 - Accurate interatomic potentials for Ni, Al, and Ni3Al.pdf} } +@article{wang2008phase, + author = {Wang, Jian and Hoagland, Richard G and Misra, Amit}, + title = {Phase transition and dislocation nucleation in Cu--Nb layered composites during physical vapor deposition}, + journal = {Journal of Materials Research}, + publisher = {Cambridge University Press}, + year = {2008}, + number = {4}, + volume = {23}, + pages = {1009--1014} +} + @article{Wang_2009, author = {Wang, Jian and Hoagland, Richard G. and Misra, Amit}, title = {Room-temperature dislocation climb in metallic interfaces}, @@ -3208,7 +4700,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {13}, volume = {94}, pages = {131910}, - url = {https://doi.org/10.1063%2F1.3111137}, + url = {https://doi.org/10.1063\%2F1.3111137}, doi = {10.1063/1.3111137} } @@ -3221,7 +4713,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {may}, volume = {56}, pages = {156--172}, - url = {https://doi.org/10.1016%2Fj.ijplas.2013.11.009}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2013.11.009}, doi = {10.1016/j.ijplas.2013.11.009} } @@ -3235,7 +4727,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {7}, volume = {67}, pages = {1515--1525}, - url = {https://doi.org/10.1007%2Fs11837-015-1454-0}, + url = {https://doi.org/10.1007\%2Fs11837-015-1454-0}, doi = {10.1007/s11837-015-1454-0} } @@ -3249,21 +4741,22 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {1}, volume = {5}, pages = {1--19}, - url = {https://doi.org/10.1080%2F21663831.2016.1225321}, + url = {https://doi.org/10.1080\%2F21663831.2016.1225321}, doi = {10.1080/21663831.2016.1225321} } @article{Wang_2017, - author = {Wang, Z. G. and Zhou, W. and Fu, L. M. and Wang, J. F. and Luo, R. C. and Han, X. C. and Chen, B. and Wang, X. D.}, - title = {Effect of coherent L12 nanoprecipitates on the tensile behavior of a fcc-based high-entropy alloy}, - journal = {Materials Science and Engineering: A}, - publisher = {Elsevier BV}, + author = {Wang, Jian and Zhou, Qing and Shao, Shuai and Misra, Amit}, + title = {Strength and plasticity of nanolaminated materials}, + journal = {Materials Research Letters}, + publisher = {Informa UK Limited}, year = {2017}, - month = {jun}, - volume = {696}, - pages = {503--510}, - url = {https://doi.org/10.1016%2Fj.msea.2017.04.111}, - doi = {10.1016/j.msea.2017.04.111} + month = {sep}, + number = {1}, + volume = {5}, + pages = {1--19}, + url = {https://doi.org/10.1080\%2F21663831.2016.1225321}, + doi = {10.1080/21663831.2016.1225321} } @article{WANG_2019, @@ -3276,10 +4769,23 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {8}, volume = {29}, pages = {1621--1630}, - url = {https://doi.org/10.1016%2Fs1003-6326%2819%2965069-7}, + url = {https://doi.org/10.1016\%2Fs1003-6326\%2819\%2965069-7}, doi = {10.1016/s1003-6326(19)65069-7} } +@article{Wang_2020, + author = {Wang, C. J. and Yao, B. N. and Liu, Z. R. and Kong, X. F. and Legut, D. and Zhang, R. F. and Deng, Y.}, + title = {Effects of solutes on dislocation nucleation and interface sliding of bimetal semi-coherent interface}, + journal = {International Journal of Plasticity}, + publisher = {Elsevier BV}, + year = {2020}, + month = {aug}, + volume = {131}, + pages = {102725}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2020.102725}, + doi = {10.1016/j.ijplas.2020.102725} +} + @article{wang_atomistic_2008, author = {Wang, J. and Hoagland, R. G. and Hirth, J. P. and Misra, A.}, title = {Atomistic modeling of the interaction of glide dislocations with "weak" interfaces}, @@ -3299,7 +4805,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{wang_frank_2013, author = {Wang, Shuaichuang and Lu, Guo and Zhang, Guangcai}, - title = {A {Frank} scheme of determining the {Burgers} vectors of dislocations in a {FCC} crystal}, + title = {A Frank scheme of determining the Burgers vectors of dislocations in a FCC crystal}, journal = {Computational Materials Science}, year = {2013}, month = {February}, @@ -3329,7 +4835,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{wang_material_2012, author = {Wang, Irene}, - title = {Material {Characterization} of {Electrodeposited} {Copper}-{Nickel} {Nanolaminated} {Alloy} by {SEM}, {EDS}, and {XRD}}, + title = {Material Characterization of Electrodeposited Copper-Nickel Nanolaminated Alloy by SEM, EDS, and XRD}, year = {2012}, month = {September}, url = {https://digital.lib.washington.edu/researchworks/handle/1773/20802}, @@ -3340,7 +4846,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{wang_strong_2015, author = {Wang, Jiangwei and Sansoz, Frederic and Deng, Chuang and Xu, Gang and Han, Gaorong and Mao, Scott X.}, - title = {Strong {Hall}-{Petch} {Type} {Behavior} in the {Elastic} {Strain} {Limit} of {Nanotwinned} {Gold} {Nanowires}}, + title = {Strong Hall-Petch Type Behavior in the Elastic Strain Limit of Nanotwinned Gold Nanowires}, journal = {Nano Letters}, year = {2015}, number = {6}, @@ -3410,13 +4916,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {5}, volume = {79}, pages = {703--716}, - url = {https://doi.org/10.1080%2F13642819908205744}, + url = {https://doi.org/10.1080\%2F13642819908205744}, doi = {10.1080/13642819908205744} } @article{Williams_2006, author = {Williams, P L and Mishin, Y and Hamilton, J C}, - title = {An embedded-atom potential for the {Cu}–{Ag} system}, + title = {An embedded-atom potential for the Cu–Ag system}, journal = {Modelling and Simulation in Materials Science and Engineering}, publisher = {IOP Publishing}, year = {2006}, @@ -3424,7 +4930,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {5}, volume = {14}, pages = {817--833}, - url = {https://doi.org/10.1088%2F0965-0393%2F14%2F5%2F002}, + url = {https://doi.org/10.1088\%2F0965-0393\%2F14\%2F5\%2F002}, doi = {10.1088/0965-0393/14/5/002} } @@ -3445,14 +4951,14 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{wood_lattice_2002, author = {Wood, R M}, - title = {The {Lattice} {Constants} of {High} {Purity} {Alpha} {Titanium}}, + title = {The Lattice Constants of High Purity Alpha Titanium}, journal = {Proceedings of the Physical Society}, year = {2002}, number = {3}, volume = {80}, pages = {783--786}, doi = {10.1088/0370-1328/80/3/323}, - abstract = {Lattice constants have been determined for a specimen of alpha titanium of greater purity than hitherto examined. Values of a0 = 2.95111 {\textbackslash}AA ± 6 × 10-5 and c0 = 4.684 33 {\textbackslash}AA ± 10 × 10-5 differ significantly from previous, accepted figures obtained by Clark in 1949. Comparative impurity contents for two grades of pure titanium are given.}, + abstract = {Lattice constants have been determined for a specimen of alpha titanium of greater purity than hitherto examined. Values of a0 = 2.95111 Å ± 6 × 10-5 and c0 = 4.684 33 Å ± 10 × 10-5 differ significantly from previous, accepted figures obtained by Clark in 1949. Comparative impurity contents for two grades of pure titanium are given.}, file = {/home/aselimov/docs/My Library/files/650/Wood - 2002 - The Lattice Constants of High Purity Alpha Titanium(2).pdf}, issn = {0370-1328} } @@ -3467,7 +4973,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {20}, volume = {111}, pages = {7197--7201}, - url = {https://doi.org/10.1073%2Fpnas.1324069111}, + url = {https://doi.org/10.1073\%2Fpnas.1324069111}, doi = {10.1073/pnas.1324069111} } @@ -3481,7 +4987,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {47}, volume = {112}, pages = {14501--14505}, - url = {https://doi.org/10.1073%2Fpnas.1517193112}, + url = {https://doi.org/10.1073\%2Fpnas.1517193112}, doi = {10.1073/pnas.1517193112} } @@ -3494,10 +5000,23 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {aug}, number = {9}, volume = {24}, - url = {https://doi.org/10.1007%2Fs00894-018-3792-7}, + url = {https://doi.org/10.1007\%2Fs00894-018-3792-7}, doi = {10.1007/s00894-018-3792-7} } +@article{Wu_2020, + author = {Wu, Cheng-Da and Huang, Bo-Xun and Li, He-Xing}, + title = {Effects of interfacial defect on deformation and mechanical properties of Cu/Ni bilayer—A molecular dynamics study}, + journal = {Thin Solid Films}, + publisher = {Elsevier BV}, + year = {2020}, + month = {aug}, + volume = {707}, + pages = {138050}, + url = {https://doi.org/10.1016\%2Fj.tsf.2020.138050}, + doi = {10.1016/j.tsf.2020.138050} +} + @article{Wu_2020a, author = {Wu, Cheng-Da and Fang, Te-Hua and Su, Wen-Cheng and Fan, Yu-Cheng}, title = {Effects of constituting material and interfacial crack on mechanical response of nanoscale metallic bilayers – a quasi-continuum study}, @@ -3508,26 +5027,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {15}, volume = {46}, pages = {1155--1163}, - url = {https://doi.org/10.1080%2F08927022.2020.1806263}, + url = {https://doi.org/10.1080\%2F08927022.2020.1806263}, doi = {10.1080/08927022.2020.1806263} } -@article{Wu_2020, - author = {Wu, Cheng-Da and Huang, Bo-Xun and Li, He-Xing}, - title = {Effects of interfacial defect on deformation and mechanical properties of Cu/Ni bilayer—A molecular dynamics study}, - journal = {Thin Solid Films}, - publisher = {Elsevier BV}, - year = {2020}, - month = {aug}, - volume = {707}, - pages = {138050}, - url = {https://doi.org/10.1016%2Fj.tsf.2020.138050}, - doi = {10.1016/j.tsf.2020.138050} -} - @article{wu_generalized-stacking-fault_2010, author = {Wu, Xiaozhi and Wang, Rui and Wang, Shaofeng}, - title = {Generalized-stacking-fault energy and surface properties for {HCP} metals: {A} first-principles study}, + title = {Generalized-stacking-fault energy and surface properties for HCP metals: A first-principles study}, journal = {Applied Surface Science}, year = {2010}, number = {11}, @@ -3543,14 +5049,14 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{Xiang_2018, author = {Xiang, Meizhen and Liao, Yi and Wang, Kun and Lu, Guo and Chen, Jun}, - title = {Shock-induced plasticity in semi-coherent \{111\} Cu-Ni multilayers}, + title = {Shock-induced plasticity in semi-coherent 111 Cu-Ni multilayers}, journal = {International Journal of Plasticity}, publisher = {Elsevier BV}, year = {2018}, month = {apr}, volume = {103}, pages = {23--38}, - url = {https://doi.org/10.1016%2Fj.ijplas.2017.12.005}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2017.12.005}, doi = {10.1016/j.ijplas.2017.12.005} } @@ -3563,13 +5069,23 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {apr}, volume = {139}, pages = {102944}, - url = {https://doi.org/10.1016%2Fj.ijplas.2021.102944}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2021.102944}, doi = {10.1016/j.ijplas.2021.102944} } +@article{xiong2016coarse, + author = {Xiong, Liming and Rigelesaiyin, Ji and Chen, Xiang and Xu, Shuozhi and McDowell, David L and Chen, Youping}, + title = {Coarse-grained elastodynamics of fast moving dislocations}, + journal = {Acta Materialia}, + publisher = {Elsevier}, + year = {2016}, + volume = {104}, + pages = {143--155} +} + @article{Xiong_2012, author = {Xiong, Liming and McDowell, David L. and Chen, Youping}, - title = {Nucleation and growth of dislocation loops in {Cu}, {Al} and {Si} by a concurrent atomistic-continuum method}, + title = {Nucleation and growth of dislocation loops in Cu, Al and Si by a concurrent atomistic-continuum method}, journal = {Scripta Materialia}, publisher = {Elsevier BV}, year = {2012}, @@ -3577,7 +5093,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {7-8}, volume = {67}, pages = {633--636}, - url = {https://doi.org/10.1016%2Fj.scriptamat.2012.07.026}, + url = {https://doi.org/10.1016\%2Fj.scriptamat.2012.07.026}, doi = {10.1016/j.scriptamat.2012.07.026} } @@ -3590,7 +5106,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {feb}, volume = {65}, pages = {33--42}, - url = {https://doi.org/10.1016%2Fj.ijplas.2014.08.002}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2014.08.002}, doi = {10.1016/j.ijplas.2014.08.002} } @@ -3610,15 +5126,26 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer issn = {1359-6454} } +@article{xu2016mesh, + author = {Xu, Shuozhi and Xiong, Liming and Deng, Qian and McDowell, David L}, + title = {Mesh refinement schemes for the concurrent atomistic-continuum method}, + journal = {International Journal of Solids and Structures}, + publisher = {Elsevier}, + year = {2016}, + volume = {90}, + pages = {144--152} +} + @phdthesis{Xu_2016, - title={The concurrent atomistic-continuum method: Advancements and applications in plasticity of face-centered cubic metals}, - author={Xu, Shuozhi}, - year={2016}, - school={Georgia Institute of Technology} + author = {Xu, Shuozhi}, + title = {The concurrent atomistic-continuum method: Advancements and applications in plasticity of face-centered cubic metals}, + year = {2016}, + school = {Georgia Institute of Technology} } + @article{Xu_2017, author = {Xu, Shuozhi and Xiong, Liming and Chen, Youping and McDowell, David L.}, - title = {Comparing EAM Potentials to Model Slip Transfer of Sequential Mixed Character Dislocations Across Two Symmetric Tilt Grain Boundaries in {Ni}}, + title = {Comparing EAM Potentials to Model Slip Transfer of Sequential Mixed Character Dislocations Across Two Symmetric Tilt Grain Boundaries in Ni}, journal = {JOM}, publisher = {Springer Science and Business Media LLC}, year = {2017}, @@ -3626,7 +5153,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {5}, volume = {69}, pages = {814--821}, - url = {https://doi.org/10.1007%2Fs11837-017-2302-1}, + url = {https://doi.org/10.1007\%2Fs11837-017-2302-1}, doi = {10.1007/s11837-017-2302-1} } @@ -3640,7 +5167,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {5}, volume = {98}, pages = {173--182}, - url = {https://doi.org/10.1080%2F09500839.2018.1515506}, + url = {https://doi.org/10.1080\%2F09500839.2018.1515506}, doi = {10.1080/09500839.2018.1515506} } @@ -3653,10 +5180,24 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {aug}, volume = {174}, pages = {160--172}, - url = {https://doi.org/10.1016%2Fj.actamat.2019.05.030}, + url = {https://doi.org/10.1016\%2Fj.actamat.2019.05.030}, doi = {10.1016/j.actamat.2019.05.030} } +@article{Xu_2020, + author = {Xu, Shuozhi and Li, Yang and Chen, Youping}, + title = {Si/Ge (111) Semicoherent Interfaces: Responses to an In-Plane Shear and Interactions with Lattice Dislocations}, + journal = {physica status solidi (b)}, + publisher = {Wiley}, + year = {2020}, + month = {aug}, + volume = {257}, + pages = {2000274}, + url = {https://doi.org/10.1002\%2Fpssb.202000274}, + doi = {10.1002/pssb.202000274}, + issue = {12} +} + @article{Xu_2020a, author = {Xu, Shuozhi and Mianroodi, Jaber R. and Hunter, Abigail and Svendsen, Bob and Beyerlein, Irene J.}, title = {Comparative modeling of the disregistry and Peierls stress for dissociated edge and screw dislocations in Al}, @@ -3666,27 +5207,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {jun}, volume = {129}, pages = {102689}, - url = {https://doi.org/10.1016%2Fj.ijplas.2020.102689}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2020.102689}, doi = {10.1016/j.ijplas.2020.102689} } -@article{Xu_2020, - author = {Xu, Shuozhi and Li, Yang and Chen, Youping}, - title = {{Si}/{Ge} (111) Semicoherent Interfaces: Responses to an In-Plane Shear and Interactions with Lattice Dislocations}, - journal = {physica status solidi (b)}, - publisher = {Wiley}, - volume = {257}, - issue = {12}, - year = {2020}, - month = {aug}, - pages = {2000274}, - url = {https://doi.org/10.1002%2Fpssb.202000274}, - doi = {10.1002/pssb.202000274} -} - @article{xu_analysis_2016, author = {Xu, Shuozhi and Xiong, Liming and Chen, Youping and McDowell, David L.}, - title = {An analysis of key characteristics of the {Frank}-{Read} source process in {FCC} metals}, + title = {An analysis of key characteristics of the Frank-Read source process in FCC metals}, journal = {Journal of the Mechanics and Physics of Solids}, year = {2016}, volume = {96}, @@ -3701,7 +5228,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{xu_edge_2016, author = {Xu, Shuozhi and Xiong, Liming and Chen, Youping and McDowell, David L.}, - title = {Edge dislocations bowing out from a row of collinear obstacles in {Al}}, + title = {Edge dislocations bowing out from a row of collinear obstacles in Al}, journal = {Scripta Materialia}, year = {2016}, volume = {123}, @@ -3714,19 +5241,19 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer } @article{xu_pycac_2018, - title={PyCAC: The concurrent atomistic-continuum simulation environment}, - author={Xu, Shuozhi and Payne, Thomas G and Chen, Hao and Liu, Yongchao and Xiong, Liming and Chen, Youping and McDowell, David L}, - journal={Journal of Materials Research}, - volume={33}, - number={7}, - pages={857}, - year={2018}, - publisher={Cambridge University Press} + author = {Xu, Shuozhi and Payne, Thomas G and Chen, Hao and Liu, Yongchao and Xiong, Liming and Chen, Youping and McDowell, David L}, + title = {PyCAC: The concurrent atomistic-continuum simulation environment}, + journal = {Journal of Materials Research}, + publisher = {Cambridge University Press}, + year = {2018}, + number = {7}, + volume = {33}, + pages = {857} } @article{xu_quasistatic_2015, author = {Xu, Shuozhi and Che, Rui and Xiong, Liming and Chen, Youping and McDowell, David L.}, - title = {A quasistatic implementation of the concurrent atomistic-continuum method for {FCC} crystals}, + title = {A quasistatic implementation of the concurrent atomistic-continuum method for FCC crystals}, journal = {International Journal of Plasticity}, year = {2015}, volume = {72}, @@ -3741,7 +5268,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{xu_sequential_2016, author = {Xu, Shuozhi and Xiong, Liming and Chen, Youping and McDowell, David L}, - title = {Sequential slip transfer of mixed-character dislocations across $\Sigma$3 coherent twin boundary in FCC metals: a concurrent atomistic-continuum study}, + title = {Sequential slip transfer of mixed-character dislocations across $Σ$3 coherent twin boundary in FCC metals: a concurrent atomistic-continuum study}, journal = {npj Computational Materials}, year = {2016}, month = {November}, @@ -3758,7 +5285,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{xu_shear_2017, author = {Xu, Shuozhi and Xiong, Liming and Chen, Youping and McDowell, David L.}, - title = {Shear stress- and line length-dependent screw dislocation cross-slip in {FCC} {Ni}}, + title = {Shear stress- and line length-dependent screw dislocation cross-slip in FCC Ni}, journal = {Acta Materialia}, year = {2017}, volume = {122}, @@ -3787,6 +5314,44 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer keyword = {molecular dynamics method, nanostructured materials, nucleation, plastic deformation, slip, stress-strain relations, tungsten, twin boundaries, yield strength} } +@article{Yadav_2017, + author = {Yadav, S. K. and Shao, S. and Chen, Y. and Wang, J. and Liu, X. -Y.}, + title = {Atomistic modeling of Mg/Nb interfaces: shear strength and interaction with lattice glide dislocations}, + journal = {Journal of Materials Science}, + publisher = {Springer Science and Business Media LLC}, + year = {2017}, + month = {oct}, + number = {8}, + volume = {53}, + pages = {5733--5744}, + url = {https://doi.org/10.1007\%2Fs10853-017-1703-4}, + doi = {10.1007/s10853-017-1703-4} +} + +@article{yahalom1989structure, + author = {Yahalom, J and Tessier, DF and Timsit, RS and Rosenfeld, AM and Mitchell, DF and Robinson, PT}, + title = {Structure of composition-modulated Cu/Ni thin films prepared by electrodeposition}, + journal = {Journal of Materials Research}, + publisher = {Springer}, + year = {1989}, + number = {4}, + volume = {4}, + pages = {755--758} +} + +@article{Yan_2016, + author = {Yan, X. L. and Liu, Y. and Swart, H. C. and Wang, J. Y. and Terblans, J. J.}, + title = {Investigation of interdiffusion and depth resolution in Cu/Ni multilayers by means of AES depth profiling}, + journal = {Applied Surface Science}, + publisher = {Elsevier BV}, + year = {2016}, + month = {feb}, + volume = {364}, + pages = {567--572}, + url = {https://doi.org/10.1016\%2Fj.apsusc.2015.12.151}, + doi = {10.1016/j.apsusc.2015.12.151} +} + @article{Yang_2015, author = {Yang, Shengfeng and Chen, Youping}, title = {Concurrent atomistic and continuum simulation of bi-crystal strontium titanate with tilt grain boundary}, @@ -3797,23 +5362,10 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {2175}, volume = {471}, pages = {20140758}, - url = {https://doi.org/10.1098%2Frspa.2014.0758}, + url = {https://doi.org/10.1098\%2Frspa.2014.0758}, doi = {10.1098/rspa.2014.0758} } -@article{Yang_2020a, - author = {Yang, Hui and Zhu, Linggang and Zhang, Ruifeng and Zhou, Jian and Sun, Zhimei}, - title = {Influence of high stacking-fault energy on the dissociation mechanisms of misfit dislocations at semi-coherent interfaces}, - journal = {International Journal of Plasticity}, - publisher = {Elsevier BV}, - year = {2020}, - month = {mar}, - volume = {126}, - pages = {102610}, - url = {https://doi.org/10.1016%2Fj.ijplas.2019.09.016}, - doi = {10.1016/j.ijplas.2019.09.016} -} - @article{Yang_2020, author = {Yang, Hui and Zhu, Linggang and Zhang, Ruifeng and Zhou, Jian and Sun, Zhimei}, title = {Shearing dominated by the coupling of the interfacial misfit and atomic bonding at the FCC (111) semi-coherent interfaces}, @@ -3823,10 +5375,23 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {jan}, volume = {186}, pages = {108294}, - url = {https://doi.org/10.1016%2Fj.matdes.2019.108294}, + url = {https://doi.org/10.1016\%2Fj.matdes.2019.108294}, doi = {10.1016/j.matdes.2019.108294} } +@article{Yang_2020a, + author = {Yang, Hui and Zhu, Linggang and Zhang, Ruifeng and Zhou, Jian and Sun, Zhimei}, + title = {Influence of high stacking-fault energy on the dissociation mechanisms of misfit dislocations at semi-coherent interfaces}, + journal = {International Journal of Plasticity}, + publisher = {Elsevier BV}, + year = {2020}, + month = {mar}, + volume = {126}, + pages = {102610}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2019.09.016}, + doi = {10.1016/j.ijplas.2019.09.016} +} + @article{yang_concurrent_2013, author = {Yang, Shengfeng and Xiong, Liming and Deng, Qian and Chen, Youping}, title = {Concurrent atomistic and continuum simulation of strontium titanate}, @@ -3845,11 +5410,11 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @incollection{yang_concurrent_2016, author = {Yang, Shengfeng and Chen, Youping}, - title = {Concurrent {Atomistic}-{Continuum} {Simulation} of {Defects} in {Polyatomic} {Ionic} {Materials}}, + title = {Concurrent Atomistic-Continuum Simulation of Defects in Polyatomic Ionic Materials}, publisher = {Springer}, year = {2016}, pages = {261--296}, - booktitle = {Multiscale {Materials} {Modeling} for {Nanomechanics}`}, + booktitle = {Multiscale Materials Modeling for Nanomechanics`}, edition = {Vol. 245}, file = {/home/aselimov/docs/My Library/files/639/Yang, Chen - 2016 - Concurrent Atomistic-Continuum Simulation of Defects in Polyatomic Ionic Materials(2).pdf} } @@ -3863,7 +5428,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {feb}, volume = {247}, pages = {106857}, - url = {https://doi.org/10.1016%2Fj.cpc.2019.07.020}, + url = {https://doi.org/10.1016\%2Fj.cpc.2019.07.020}, doi = {10.1016/j.cpc.2019.07.020} } @@ -3877,19 +5442,24 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {2}, volume = {125}, pages = {025112}, - url = {https://doi.org/10.1063%2F1.5055901}, + url = {https://doi.org/10.1063\%2F1.5055901}, doi = {10.1063/1.5055901} } -@article{Youngs_2009, - author = {Youngs, T. G. A.}, - title = {Aten-An application for the creation, editing, and visualization of coordinates for glasses, liquids, crystals, and molecules}, - journal = {Journal of Computational Chemistry}, - publisher = {Wiley}, - year = {2009}, - pages = {NA--NA}, - url = {https://doi.org/10.1002%2Fjcc.21359}, - doi = {10.1002/jcc.21359} +@article{yu_strengthening_2013, + author = {Yu, K.Y. and Liu, Y. and Rios, S. and Wang, H. and Zhang, X.}, + title = {Strengthening mechanisms of Ag/Ni immiscible multilayers with fcc/fcc interface}, + journal = {Surface and Coatings Technology}, + year = {2013}, + month = {December}, + volume = {237}, + pages = {269--275}, + url = {https://www.sciencedirect.com/science/article/pii/S0257897213005483}, + doi = {10.1016/J.SURFCOAT.2013.05.051}, + abstract = {We investigate the microstructure and mechanical properties of sputtered face-centered cubic (fcc) Ag/Ni multilayers with varying individual layer thickness h of 1–200 nm deposited on Si (100) and Si (111) substrates. Both multilayer systems have similar \textless111\textgreater fiber texture with predominantly incoherent Ag/Ni interfaces. Superlattice structure arises when h decreases to less than 5nm. Indentation hardness of both Ag/Ni systems shows similar significant size dependence when h \textgreater 3nm. Strengthening mechanisms in Ag/Ni systems are discussed and compared to those in Cu/Ni and Ag/Cu systems with fcc/fcc interfaces.}, + file = {/home/aselimov/docs/My Library/files/705/Yu et al. - 2013 - Strengthening mechanisms of AgNi immiscible multilayers with fccfcc interface(2).pdf}, + issn = {0257-8972}, + keyword = {NMM} } @article{yuan_molecular_2007, @@ -3908,22 +5478,6 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer issn = {0924-0136} } -@article{yu_strengthening_2013, - author = {Yu, K.Y. and Liu, Y. and Rios, S. and Wang, H. and Zhang, X.}, - title = {Strengthening mechanisms of {Ag}/{Ni} immiscible multilayers with fcc/fcc interface}, - journal = {Surface and Coatings Technology}, - year = {2013}, - month = {December}, - volume = {237}, - pages = {269--275}, - url = {https://www.sciencedirect.com/science/article/pii/S0257897213005483}, - doi = {10.1016/J.SURFCOAT.2013.05.051}, - abstract = {We investigate the microstructure and mechanical properties of sputtered face-centered cubic (fcc) Ag/Ni multilayers with varying individual layer thickness h of 1–200 nm deposited on Si (100) and Si (111) substrates. Both multilayer systems have similar {\textbackslash}textless111{\textbackslash}textgreater fiber texture with predominantly incoherent Ag/Ni interfaces. Superlattice structure arises when h decreases to less than 5nm. Indentation hardness of both Ag/Ni systems shows similar significant size dependence when h {\textbackslash}textgreater 3nm. Strengthening mechanisms in Ag/Ni systems are discussed and compared to those in Cu/Ni and Ag/Cu systems with fcc/fcc interfaces.}, - file = {/home/aselimov/docs/My Library/files/705/Yu et al. - 2013 - Strengthening mechanisms of AgNi immiscible multilayers with fccfcc interface(2).pdf}, - issn = {0257-8972}, - keyword = {NMM} -} - @article{Zbib_2012, author = {Zbib, H. M. and Mastorakos, I. N. and Bahr, D. F.}, title = {Deformation mechanisms, size effects, and strain hardening in nanoscale metallic multilayers under nanoindentation}, @@ -3934,13 +5488,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {4}, volume = {112}, pages = {044307}, - url = {https://doi.org/10.1063%2F1.4748149}, + url = {https://doi.org/10.1063\%2F1.4748149}, doi = {10.1063/1.4748149} } @article{zeng_high_2016, author = {Zeng, L.F. and Gao, R. and Fang, Q.F. and Wang, X.P. and Xie, Z.M. and Miao, S. and Hao, T. and Zhang, T.}, - title = {High strength and thermal stability of bulk {Cu}/{Ta} nanolamellar multilayers fabricated by cross accumulative roll bonding}, + title = {High strength and thermal stability of bulk Cu/Ta nanolamellar multilayers fabricated by cross accumulative roll bonding}, journal = {Acta Materialia}, year = {2016}, month = {May}, @@ -3948,12 +5502,39 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pages = {341--351}, url = {https://www.sciencedirect.com/science/article/pii/S1359645416301872}, doi = {10.1016/J.ACTAMAT.2016.03.034}, - abstract = {Bulk Cu/Ta nanolamellar multilayers with an individual layer thickness from several micrometers down to 50 nm were successfully fabricated via a combination of cross accumulative roll bonding (CARB) and an intermediate annealing step. This fabrication technique allowed to effectively suppress the formation of plastic instabilities and edge cracks during the repeated rolling process. A transition of the layered morphology from non-planar interfaces at the submicron level to nearly planar interfaces at the nano-scale was observed with decreasing layer thickness. High resolution transmission electron microscopy, selected area electron diffraction and X-ray diffraction were performed, and the results indicate that the Cu/Ta nanolamellar multilayers with a layer thickness of 50 nm show a \{100\}Ta[110]∥\{110\}Cu[111] rolling texture relationship. Tensile tests revealed that the ultimate tensile strength of the composite was up to 950 MPa, which is approximately 5 times higher than that of the initial pure Cu and Ta. The hardness of the prepared multilayer maintained unchanged even after an annealing at 500 °C for 1 h. These unique properties are attributed to an atomically flat bimetal interface and the low amount of homophase grain boundaries resulted from the CARB process.}, + abstract = {Bulk Cu/Ta nanolamellar multilayers with an individual layer thickness from several micrometers down to 50 nm were successfully fabricated via a combination of cross accumulative roll bonding (CARB) and an intermediate annealing step. This fabrication technique allowed to effectively suppress the formation of plastic instabilities and edge cracks during the repeated rolling process. A transition of the layered morphology from non-planar interfaces at the submicron level to nearly planar interfaces at the nano-scale was observed with decreasing layer thickness. High resolution transmission electron microscopy, selected area electron diffraction and X-ray diffraction were performed, and the results indicate that the Cu/Ta nanolamellar multilayers with a layer thickness of 50 nm show a \100\Ta[110]∥\110\Cu[111] rolling texture relationship. Tensile tests revealed that the ultimate tensile strength of the composite was up to 950 MPa, which is approximately 5 times higher than that of the initial pure Cu and Ta. The hardness of the prepared multilayer maintained unchanged even after an annealing at 500 °C for 1 h. These unique properties are attributed to an atomically flat bimetal interface and the low amount of homophase grain boundaries resulted from the CARB process.}, file = {/home/aselimov/docs/My Library/files/861/Zeng et al. - 2016 - High strength and thermal stability of bulk CuTa nanolamellar multilayers fabricated by cross accumulative roll bon.pdf}, issn = {1359-6454}, keyword = {NMM} } +@article{Zepeda_Ruiz_2017, + author = {Zepeda-Ruiz, Luis A. and Stukowski, Alexander and Oppelstrup, Tomas and Bulatov, Vasily V.}, + title = {Probing the limits of metal plasticity with molecular dynamics simulations}, + journal = {Nature}, + publisher = {Springer Science and Business Media LLC}, + year = {2017}, + month = {sep}, + number = {7677}, + volume = {550}, + pages = {492--495}, + url = {https://doi.org/10.1038\%2Fnature23472}, + doi = {10.1038/nature23472} +} + +@article{Zhang_2012, + author = {Zhang, X. and Fu, E. G. and Li, Nan and Misra, A. and Wang, Y. -Q. and Shao, L. and Wang, H.}, + title = {Design of Radiation Tolerant Nanostructured Metallic Multilayers}, + journal = {Journal of Engineering Materials and Technology}, + publisher = {ASME International}, + year = {2012}, + month = {aug}, + number = {4}, + volume = {134}, + url = {https://doi.org/10.1115\%2F1.4006979}, + doi = {10.1115/1.4006979} +} + @article{Zhang_2014, author = {Zhang, R. F. and Germann, T. C. and Liu, X. Y. and Wang, J. and Beyerlein, I. J.}, title = {Layer size effect on the shock compression behavior of fcc–bcc nanolaminates}, @@ -3963,7 +5544,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {oct}, volume = {79}, pages = {74--83}, - url = {https://doi.org/10.1016%2Fj.actamat.2014.07.016}, + url = {https://doi.org/10.1016\%2Fj.actamat.2014.07.016}, doi = {10.1016/j.actamat.2014.07.016} } @@ -3976,10 +5557,36 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {oct}, volume = {138}, pages = {224--236}, - url = {https://doi.org/10.1016%2Fj.actamat.2017.07.053}, + url = {https://doi.org/10.1016\%2Fj.actamat.2017.07.053}, doi = {10.1016/j.actamat.2017.07.053} } +@article{Zhang_2017a, + author = {Zhang, J. Y. and Wu, K. and Zhang, L. Y. and Wang, Y. Q. and Liu, G. and Sun, J.}, + title = {Unraveling the correlation between Hall-Petch slope and peak hardness in metallic nanolaminates}, + journal = {International Journal of Plasticity}, + publisher = {Elsevier BV}, + year = {2017}, + month = {sep}, + volume = {96}, + pages = {120--134}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2017.04.020}, + doi = {10.1016/j.ijplas.2017.04.020} +} + +@article{Zhang_2020, + author = {Zhang, L. F. and Gao, R. and Zhao, B. L. and Sun, M. and Jing, K. and Wang, X. P. and Hao, T. and Xie, Z. M. and Liu, R. and Fang, Q. F. and Liu, C. S.}, + title = {Effects of annealing temperature and layer thickness on hardening behavior in cross accumulative roll bonded Cu/Fe nanolamellar composite}, + journal = {Journal of Alloys and Compounds}, + publisher = {Elsevier BV}, + year = {2020}, + month = {jun}, + volume = {827}, + pages = {154312}, + url = {https://doi.org/10.1016\%2Fj.jallcom.2020.154312}, + doi = {10.1016/j.jallcom.2020.154312} +} + @article{zhang_length-scale-dependent_2011, author = {Zhang, J. Y. and Zhang, X. and Wang, R. H. and Lei, S. Y. and Zhang, P. and Niu, J. J. and Liu, G. and Zhang, G. J. and Sun, J.}, title = {Length-scale-dependent deformation and fracture behavior of Cu/X (X = Nb, Zr) multilayers: The constraining effects of the ductile phase on the brittle phase}, @@ -4006,14 +5613,14 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer pages = {194--205}, url = {https://www.sciencedirect.com/science/article/pii/S1359645416303536}, doi = {10.1016/J.ACTAMAT.2016.05.015}, - abstract = {By means of atomistic simulations and interface dislocation theory, the mechanism of dislocation nucleation and shear resistance of various stepped fcc/bcc interfaces are comparatively studied using the Kurdjumov-Sachs (KS) Cu/Nb interface as a prototype. It is found that the introduction of atomic steps at the flat Cu\{111\}/\{110\}Nb KS interface does not change the most preferred slip systems, but influences the nucleation sites at the interface during tension loading, indicating that the flat and stepped interfaces possesses comparable energetic barriers for dislocation nucleation. During shear loading, the steps may significantly enhance the resistance to interface sliding by propagating partial dislocations that facilitate the emission and growth of parallel twins via cross slip. When the parallel twins are not favored or are hindered, the interface sliding will dominate in a “climbing peak-to-valley” manner. These results provide an effective pathway to solve the trade-off dilemma between dislocation nucleation and interface sliding by appropriately manipulating atomic steps at the flat interface in the design of high-strength metallic materials.}, + abstract = {By means of atomistic simulations and interface dislocation theory, the mechanism of dislocation nucleation and shear resistance of various stepped fcc/bcc interfaces are comparatively studied using the Kurdjumov-Sachs (KS) Cu/Nb interface as a prototype. It is found that the introduction of atomic steps at the flat Cu\111\/\110\Nb KS interface does not change the most preferred slip systems, but influences the nucleation sites at the interface during tension loading, indicating that the flat and stepped interfaces possesses comparable energetic barriers for dislocation nucleation. During shear loading, the steps may significantly enhance the resistance to interface sliding by propagating partial dislocations that facilitate the emission and growth of parallel twins via cross slip. When the parallel twins are not favored or are hindered, the interface sliding will dominate in a “climbing peak-to-valley” manner. These results provide an effective pathway to solve the trade-off dilemma between dislocation nucleation and interface sliding by appropriately manipulating atomic steps at the flat interface in the design of high-strength metallic materials.}, file = {/home/aselimov/docs/My Library/files/882/Zhang et al. - 2016 - Manipulating dislocation nucleation and shear resistance of bimetal interfaces by atomic steps.pdf}, issn = {1359-6454} } @article{zhang_modulation_2015, author = {Zhang, B. and Kou, Y. and Xia, Y.Y. and Zhang, X.}, - title = {Modulation of strength and plasticity of multiscale {Ni}/{Cu} laminated composites}, + title = {Modulation of strength and plasticity of multiscale Ni/Cu laminated composites}, journal = {Materials Science and Engineering: A}, year = {2015}, month = {June}, @@ -4043,7 +5650,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{zhang_stress-assisted_2017, author = {Zhang, Yang and Tucker, Garritt J. and Trelewicz, Jason R.}, - title = {Stress-assisted grain growth in nanocrystalline metals: {Grain} boundary mediated mechanisms and stabilization through alloying}, + title = {Stress-assisted grain growth in nanocrystalline metals: Grain boundary mediated mechanisms and stabilization through alloying}, journal = {Acta Materialia}, year = {2017}, volume = {131}, @@ -4058,7 +5665,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{zhang_universal_2016, author = {Zhang, Yuting and Li, Yujie and Ding, Xiuli}, - title = {Universal {Format} of {Shape} {Function} for {Numerical} {Analysis} using {Multiple} {Element} {Forms} {Universal} {Format} of {Shape} {Function} using {Linear} {Hexahedron}}, + title = {Universal Format of Shape Function for Numerical Analysis using Multiple Element Forms Universal Format of Shape Function using Linear Hexahedron}, journal = {Advanced Science and Technology Letters}, year = {2016}, number = {Ast}, @@ -4077,7 +5684,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {oct}, number = {1}, volume = {5}, - url = {https://doi.org/10.1038%2Fsrep15428}, + url = {https://doi.org/10.1038\%2Fsrep15428}, doi = {10.1038/srep15428} } @@ -4091,7 +5698,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {38}, volume = {45}, pages = {20021--20031}, - url = {https://doi.org/10.1016%2Fj.ijhydene.2020.04.291}, + url = {https://doi.org/10.1016\%2Fj.ijhydene.2020.04.291}, doi = {10.1016/j.ijhydene.2020.04.291} } @@ -4104,7 +5711,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {mar}, volume = {138}, pages = {102937}, - url = {https://doi.org/10.1016%2Fj.ijplas.2021.102937}, + url = {https://doi.org/10.1016\%2Fj.ijplas.2021.102937}, doi = {10.1016/j.ijplas.2021.102937} } @@ -4117,7 +5724,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer volume = {90}, pages = {903--914}, doi = {10.1080/09500839.2010.521526}, - abstract = {The loss of coherency of interphase boundaries in two-phase titanium alloys during deformation was analyzed. The energy of the undeformed interphase boundary was first determined by means of the van der Merwe model for stepped interfaces. The subsequent loss of coherency was ascribed to the increase of interphase energy due to absorption of lattice dislocations and was quantified by a relation similar to the Read-Shockley equation for low-angle boundaries in single-phase alloys. It was found that interphase boundaries lose their coherency by a strain of approximately 0.5 at T=800\${\textbackslash}backslash\$,{\textasciicircum}\{\${\textbackslash}backslash\$circ\}C.}, + abstract = {The loss of coherency of interphase boundaries in two-phase titanium alloys during deformation was analyzed. The energy of the undeformed interphase boundary was first determined by means of the van der Merwe model for stepped interfaces. The subsequent loss of coherency was ascribed to the increase of interphase energy due to absorption of lattice dislocations and was quantified by a relation similar to the Read-Shockley equation for low-angle boundaries in single-phase alloys. It was found that interphase boundaries lose their coherency by a strain of approximately 0.5 at T=800\$\backslash\$,\textasciicircum\\$\backslash\$circ\C.}, file = {/home/aselimov/docs/My Library/files/707/Zherebtsov, Salishchev, Lee Semiatin - 2010 - Loss of coherency of the alphabeta interface boundary in titanium alloys during deformatio.pdf}, issn = {09500839}, keyword = {plastic deformation, interfaces, alpha-Ti, beta-Ti, coherency, interface, titanium alloys} @@ -4125,11 +5732,11 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer @article{zhigilei_introduction_2013, author = {Zhigilei, Leonid}, - title = {Introduction to interatomic potentials ({I})}, + title = {Introduction to interatomic potentials (I)}, journal = {None}, year = {2013}, number = {I}, - abstract = {In order to use Molecular Dynamics or Monte Carlo methods we have to define the rules that are governing interaction of atoms in the system. In classical and semi-classical simulations these rules are often expressed in terms of potential functions. The potential function U(r 1 , r 2 , {\textbackslash}ldots, r N) describes how the potential energy of a system of N atoms depends on the coordinates of the atoms, r 1 , r 2 , {\textbackslash}ldots, r N . It is assumed the electrons adjust to new atomic positions much faster than the motion of the atomic nuclei (Born-Oppenheimer approximation). The forces in MD simulation are defined by the potential, How to obtain the potential function for a particular system? Introduction to interatomic potentials (I)}, + abstract = {In order to use Molecular Dynamics or Monte Carlo methods we have to define the rules that are governing interaction of atoms in the system. In classical and semi-classical simulations these rules are often expressed in terms of potential functions. The potential function U(r 1 , r 2 , łdots, r N) describes how the potential energy of a system of N atoms depends on the coordinates of the atoms, r 1 , r 2 , łdots, r N . It is assumed the electrons adjust to new atomic positions much faster than the motion of the atomic nuclei (Born-Oppenheimer approximation). The forces in MD simulation are defined by the potential, How to obtain the potential function for a particular system? Introduction to interatomic potentials (I)}, file = {/home/aselimov/docs/My Library/files/831/Zhigilei - 2013 - Introduction to interatomic potentials (I)(2).pdf} } @@ -4143,7 +5750,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {9}, volume = {47}, pages = {2695--2703}, - url = {https://doi.org/10.1016%2Fs1359-6454%2899%2900127-5}, + url = {https://doi.org/10.1016\%2Fs1359-6454\%2899\%2900127-5}, doi = {10.1016/s1359-6454(99)00127-5} } @@ -4157,7 +5764,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {2037}, volume = {459}, pages = {2347--2392}, - url = {https://doi.org/10.1098%2Frspa.2003.1127}, + url = {https://doi.org/10.1098\%2Frspa.2003.1127}, doi = {10.1098/rspa.2003.1127} } @@ -4171,13 +5778,40 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {10}, volume = {8}, pages = {1821}, - url = {https://doi.org/10.3390%2Fapp8101821}, + url = {https://doi.org/10.3390\%2Fapp8101821}, doi = {10.3390/app8101821} } +@article{Zhou_2018a, + author = {Zhou, Xiaowang W. and Foster, Michael E. and Sills, Ryan B.}, + title = {An Fe-Ni-Cr embedded atom method potential for austenitic and ferritic systems}, + journal = {Journal of Computational Chemistry}, + publisher = {Wiley}, + year = {2018}, + month = {oct}, + number = {29}, + volume = {39}, + pages = {2420--2431}, + url = {https://doi.org/10.1002\%2Fjcc.25573}, + doi = {10.1002/jcc.25573} +} + +@article{Zhou_2021, + author = {Zhou, X. W. and Bartelt, N. C. and Sills, R. B.}, + title = {Enabling simulations of helium bubble nucleation and growth: A strategy for interatomic potentials}, + journal = {Physical Review B}, + publisher = {American Physical Society (APS)}, + year = {2021}, + month = {jan}, + number = {1}, + volume = {103}, + url = {https://doi.org/10.1103\%2Fphysrevb.103.014108}, + doi = {10.1103/physrevb.103.014108} +} + @article{zhou_mechanical_2015, author = {Zhou, Q. and Xie, J. Y. and Wang, F. and Huang, P. and Xu, K. W. and Lu, T. J.}, - title = {The mechanical behavior of nanoscale metallic multilayers: {A} survey}, + title = {The mechanical behavior of nanoscale metallic multilayers: A survey}, journal = {Acta Mechanica Sinica}, year = {2015}, month = {June}, @@ -4216,13 +5850,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {1}, volume = {9}, pages = {1--31}, - url = {https://doi.org/10.1080%2F21663831.2020.1796836}, + url = {https://doi.org/10.1080\%2F21663831.2020.1796836}, doi = {10.1080/21663831.2020.1796836} } @article{zhu_scale-dependent_2010, author = {Zhu, X.F. and Zhang, G.P. and Yan, C. and Zhu, S.J. and Sun, J.}, - title = {Scale-dependent fracture mode in {Cu}–{Ni} laminate composites}, + title = {Scale-dependent fracture mode in Cu–Ni laminate composites}, journal = {Philosophical Magazine Letters}, year = {2010}, month = {June}, @@ -4253,6 +5887,13 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer keyword = {NMM} } +@book{zienkiewicz2005finite, + author = {Zienkiewicz, Olek C and Taylor, Robert L and Zhu, Jian Z}, + title = {The finite element method: its basis and fundamentals}, + publisher = {Elsevier}, + year = {2005} +} + @article{Zimmerman_2001, author = {Zimmerman, J. A. and Kelchner, C. L. and Klein, P. A. and Hamilton, J. C. and Foiles, S. M.}, title = {Surface Step Effects on Nanoindentation}, @@ -4262,7 +5903,7 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer month = {oct}, number = {16}, volume = {87}, - url = {https://doi.org/10.1103%2Fphysrevlett.87.165507}, + url = {https://doi.org/10.1103\%2Fphysrevlett.87.165507}, doi = {10.1103/physrevlett.87.165507} } @@ -4276,7 +5917,8 @@ Nanolaminate materials, also referred to as “superlattices” or “multilayer number = {2}, volume = {46}, pages = {238--253}, - url = {https://doi.org/10.1016%2Fj.ijsolstr.2008.08.036}, + url = {https://doi.org/10.1016\%2Fj.ijsolstr.2008.08.036}, doi = {10.1016/j.ijsolstr.2008.08.036} } + diff --git a/scripts/md2beamer b/scripts/md2beamer index 8a2310b..0875f26 100755 --- a/scripts/md2beamer +++ b/scripts/md2beamer @@ -7,4 +7,4 @@ else out=$2 fi -pandoc -t beamer --citeproc --pdf-engine xelatex pres.md --bibliography /home/aselimov/typesetting/references.bib --csl /home/aselimov/typesetting/csl/custom_beamer_ref.csl --template press -V theme:auriga -V colortheme:auriga -o $out +pandoc -t beamer --citeproc --pdf-engine xelatex pres.md --bibliography /home/aselimov/typesetting/references.bib --csl /home/aselimov/typesetting/csl/custom_beamer_ref.csl -V theme:auriga -V colortheme:auriga -o $out diff --git a/scripts/md2pdf b/scripts/md2pdf index 42285c6..2376e92 100755 --- a/scripts/md2pdf +++ b/scripts/md2pdf @@ -6,5 +6,5 @@ if [ "$2" = '' ]; then else out=$2 fi -pandoc $1 --lua-filter="$HOME"/typesetting/pandoc_lua_filters/scholarly-metadata.lua --lua-filter="$HOME"/typesetting/pandoc_lua_filters/author-info-blocks.lua --filter=pandoc-crossref --citeproc --bibliography=/home/aselimov/typesetting/references.bib --csl=/home/aselimov/typesetting/csl/els.csl -o $out +pandoc $1 --pdf-engine=xelatex --lua-filter="$HOME"/typesetting/pandoc_lua_filters/scholarly-metadata.lua --lua-filter="$HOME"/typesetting/pandoc_lua_filters/author-info-blocks.lua --filter=pandoc-crossref --citeproc --bibliography=/home/aselimov/typesetting/references.bib --csl=/home/aselimov/typesetting/csl/els.csl -o $out