22 Commits

Author SHA1 Message Date
Alex Selimov
51079148cc Get code working with gfortran 2020-10-24 09:53:58 -04:00
Alex Selimov
b658202a1e First testing version of code 2020-10-12 13:26:58 -04:00
Alex Selimov
724e573287 Added deform box option and allowed for reading time information from restart files 2020-08-10 15:52:19 -04:00
Alex Selimov
a47c384a3f Added tags to the element and atom arrays 2020-06-29 18:51:01 -04:00
Alex Selimov
66670671b5 Notch group shape 2020-05-18 13:50:14 -04:00
Alex Selimov
fc20350748 vacancydisloop option added 2020-03-13 15:55:45 -04:00
Alex Selimov
0ad06a2d6b Working changes to boundary command 2020-03-05 16:19:30 -05:00
Alex Selimov
a1a506e17d Added delete option with delete overlap command 2020-02-06 11:18:42 -05:00
Alex Selimov
6f15daf1ec Initial working commit with bug in delete command 2020-02-05 10:57:39 -05:00
Alex Selimov
44efb4be4a Added orient and unorient options 2020-02-03 17:30:41 -05:00
Kevin Chu
1b099a17d5 Fix to makefile build order 2020-01-27 12:00:47 -05:00
Alex
347b73054b Added group option and shift command 2020-01-27 10:01:22 -05:00
Alex Selimov
c89b7d3b59 Merge branch 'ft--opt-dislloop' into development 2020-01-13 20:24:15 -05:00
Alex Selimov
fbae3a1594 Working version of CACmb capable of building simple models for lammpsCAC 2020-01-13 20:12:46 -05:00
Alex Selimov
1f1598dec9 Added Make install and fix to main 2020-01-13 09:49:42 -05:00
Alex Selimov
8fc91f4dd2 Working planar vacancy cluster algorithm 2020-01-13 09:42:57 -05:00
Alex
d0e6253d64 Working commit for dislocation generation branch 2019-12-25 16:30:18 -05:00
Alex Selimov
b0941e4482 Fixes to file reading to ensure that mode_merge works correctly 2019-12-10 19:33:46 -05:00
Alex Selimov
d624e6ed5d Added mode_convert and documentation. Created new .mb filetype which contains all necessary information for operating on simulation cells. Created framework for reading in data files, right now only .mb style files 2019-12-05 11:04:49 -05:00
Alex
ff3fc5e20a First working version of model builder with several output file types and mode_create working 2019-11-27 15:10:28 -05:00
Alex
8217e8b51c Initial commit with file writing and create mode working for atoms 2019-11-25 18:19:25 -05:00
Alex Selimov
624886bbe9 Initial commit with working atom and lattice type parsing 2019-09-25 20:11:10 -04:00