190 Commits (612cea3891460e07460e4c35f184dac9801ecc47)

Author SHA1 Message Date
Alex Selimov 0929400d19 Merge branch 'ft--option-slip-plane' into development
4 years ago
Alex Selimov a528dc4c52 Final fix to get working opt_slip_plane
4 years ago
Alex Selimov 068b5d99a9 Fix to gfortran compatibility
4 years ago
Alex Selimov 84a84e578a Working version of slip_plane ooption with effill
4 years ago
Alex Selimov b9ce916e42 Current working changes to option-slip-plane
4 years ago
Alex Selimov fa38875296 merge changes
4 years ago
Alex Selimov 51079148cc Get code working with gfortran
4 years ago
Alex Selimov f63335708b Working changes
4 years ago
Alex Selimov 22e250093b Working changes. Working on the efill code
4 years ago
Alex Selimov b5629b1563 Working changes to slip_plane code
4 years ago
Alex Selimov 2ea388b82a Current working changes with some updates to comments for accuracy
4 years ago
Alex Selimov 6e08517697 Working continuum metric calculation code
4 years ago
Alex Selimov 95e2ad0b4d Current working changes to control-box code
4 years ago
Alex Selimov 5949f04103 Working read from pycac.out file format
4 years ago
Alex Selimov dadc1f7a4a Fixed the efill option to preserve interelement discontinuities
4 years ago
Alex Selimov c42db27f57 Working redef box option
4 years ago
Alex Selimov b658202a1e First testing version of code
4 years ago
Alex Selimov fb236f4ab4 Fix to opt_orient to preserve boundary conditions
4 years ago
Alex Selimov 1e1c08e546 Added group shape all to seleect all of a specific type
4 years ago
Alex Selimov 73fca4a0d8 Added efill zigzag code which adjusts the efill option
4 years ago
Alex Selimov 4c75fac13c Working change group type command
4 years ago
Alex Selimov c4afde2743 Working changes to group
4 years ago
Alex Selimov 96e2242573 Fix to writing pycac files
4 years ago
Alex Selimov 724e573287 Added deform box option and allowed for reading time information from restart files
4 years ago
Alex Selimov 8d939ed942 Merge bcc to development branch
5 years ago
Alex Selimov a0ecc7da90 Fix to problem with read-CAC due to changes in add_atom and add_element methods)
5 years ago
Alex Selimov 2fda952d3f Merge read-cac branch into main branch
5 years ago
Alex Selimov a47c384a3f Added tags to the element and atom arrays
5 years ago
Alex Selimov 338587b7b7 Added sphere as a possible group shape
5 years ago
Alex Selimov b52d7761e0 First working version of reading in .cac format. Works for two separate orientations
5 years ago
Alex Selimov d01d0b0c57 Quick fix to code to allow for reading in larger numbers of esizes
5 years ago
Alex Selimov 65c2b380cd Added flip option to group to invert group selection
5 years ago
Alex Selimov 43025d0b67 Quick fix to efill code
5 years ago
Alex Selimov aef9da49be Added greater range of element sizes
5 years ago
Alex Selimov 080f19d644 Update .xyz file format to include element and atom files
5 years ago
Alex Selimov e5eec7a7cd Added random option which can be used to create vacancy fields
5 years ago
Alex Selimov 5dda0e3b81 Added efill option
5 years ago
Alex Selimov 8693d7aaa9 Initial testing of efill code
5 years ago
Alex Selimov 8cb9787ea2 Added functionality so you can refine elements prior to operating on the group
5 years ago
Alex Selimov b28875b3e1 Added keyword for group selection based on nodal position instead of centroid
5 years ago
Alex Selimov 32ab5a6058 Added basic basis functionality to code
5 years ago
Alex Selimov ffbe83f2f5 Added ability to have spaces in orient string if passed with quotes
5 years ago
Alex Selimov 66670671b5 Notch group shape
5 years ago
Alex Selimov 9ccc5f1caf Replaced sorting method which resulted in broken deletion algorithm
5 years ago
Alex Selimov 3a59b23be7 Working bcc crystal structure when viewing in .lmp or .vtk format
5 years ago
Alex Selimov 4038cab76f Latest working changes to read-CAC
5 years ago
Alex Selimov 284fce3c17 Add group shape id
5 years ago
Alex Selimov b3e05da6a4 Working changes for reading .cac files
5 years ago
Alex Selimov e6d7741060 Working changes to io.f90
5 years ago
Alex Selimov acd902db4b working changes to bcc files
5 years ago
Alex Selimov f6c0cf93f2 Final changes fixing remesh group
5 years ago
Alex Selimov babf4e176d Current working changes
5 years ago
Alex Selimov 9a484c86f6 Add wedge group shape option to opt_group.f90, update the documentation, and add the relevant functions to functions.f90
5 years ago
Alex Selimov 975e2b3fc1 Fix to numbering on interpolated atoms
5 years ago
Alex Selimov a9b266d757 Added sbox_ori option for when reading in restart files
5 years ago
Alex Selimov 4868a30e57 Added read_pycac subroutine
5 years ago
Alex Selimov 697dd7fa83 Change minimium element size in max remesh
5 years ago
Alex Selimov de1d230b87 Remove sub_box_arrary_bd as it isn't needed
5 years ago
Alex Selimov c11a1bb463 Added rectangular vacancy disloop
5 years ago
Alex Selimov fc20350748 vacancydisloop option added
5 years ago
Alex Selimov 44a9dbaead Add tol variable replacing lim_zero as a tolerance for real checks
5 years ago
Alex Selimov 6642c2a1b7 FIx to opt-orient command due to difference with how boundary command worked
5 years ago
Alex Selimov 0ad06a2d6b Working changes to boundary command
5 years ago
Alex Selimov d2f3c9e3ec Add check for orientation to make sure it's right handed and orthogonal
5 years ago
Alex Selimov 9038242b98 Changes to how the io works for writing restart and merging
5 years ago
Alex Selimov 1a30968dca Added the rand element code
5 years ago
Alex Selimov 27faeee5ea Working code which picks random position slightly outside element bounds
5 years ago
Alex d670bb5083 Working remesh command and remesh max command
5 years ago
Alex 5b925122df Added verbosity to remesh command
5 years ago
Alex 09c2e63155 Working element refinement
5 years ago
Alex 56994393a0 Fix to bug causing incorrrect positions. Remeshing algorithm works
5 years ago
Alex Selimov c698c31ede First version that doesn't crash, incorrectly places elements and atoms
5 years ago
Alex 20755270a4 Debugging version of code
5 years ago
Alex d0b6c595f0 Fix to outputting single element
5 years ago
Alex 6a0d441bd0 Fix to disloop code
5 years ago
Alex Selimov 1b82d98a4f Added right hand rule check to orientation in mode_create
5 years ago
Alex Selimov 9702ec85e9 Added set max esize when reading in specific files
5 years ago
Alex Selimov 98d00ea431 Fix problems with mode_create.f90
5 years ago
Alex Selimov b97986bf04 change box definition
5 years ago
Alex Selimov 3aed6966da Added possibility to select random number within range
5 years ago
Alex Selimov a1a506e17d Added delete option with delete overlap command
5 years ago
Alex Selimov 92671ea0b2 Fix to mode merge box definition
5 years ago
Alex Selimov e9521f43f3 Fix to formatting and cell neighbor loop algorithm
5 years ago
Alex Selimov 6f15daf1ec Initial working commit with bug in delete command
5 years ago
aselimov 08aa5d46df
Merge pull request #22 from aselimov/ft--option-orient
5 years ago
Alex Selimov 9be65c4510 Added delete option and update readme
5 years ago
Alex Selimov f37f19cbcf Forgot to add the option file
5 years ago
Alex Selimov 44efb4be4a Added orient and unorient options
5 years ago
Alex Selimov 58ad74ca9a Quick add of boundary option and update to readme
5 years ago
Alex Selimov 4117f31cb6 Small fix to writing to restart format
5 years ago
Alex dc42b7b925 Separated wrap option to reduce opy and pasted code. Fixed warnings and added wrapping when inserting a dislocation or loop
5 years ago
Alex Selimov 72dc7b089f Merge branch 'development' into ft--random-position-selector
5 years ago
Alex Selimov 282dcd3c58 Add random position
5 years ago
Alex Selimov a942b8e2a1 Added -ow option which allows for automatic overwriting
5 years ago
Alex Selimov 9ebdfff0a1 Added print messages to let user know whats going on
5 years ago
aselimov e91bcd5d1e
Merge pull request #16 from aselimov/ft--group-refine
5 years ago
Alex Selimov fd143783ec Added remesh option to group
5 years ago
Alex Selimov 1db2b24499 Fixes to parse_pos subroutine
5 years ago
Alex Selimov 69ab46b6e3 Fix to inf*val format for positions
5 years ago
aselimov 4e592fb4aa
Merge pull request #15 from aselimov/bg--fix-to-dislgen
5 years ago