22 Commits

Author SHA1 Message Date
Alex Selimov
4f79085956 Update to documentation 2020-04-24 12:35:41 -04:00
Alex Selimov
9a484c86f6 Add wedge group shape option to opt_group.f90, update the documentation, and add the relevant functions to functions.f90 2020-04-07 11:42:37 -04:00
Alex Selimov
a9b266d757 Added sbox_ori option for when reading in restart files 2020-03-20 13:14:26 -04:00
Alex Selimov
fc20350748 vacancydisloop option added 2020-03-13 15:55:45 -04:00
Alex Selimov
27faeee5ea Working code which picks random position slightly outside element bounds 2020-03-02 12:24:22 -05:00
Alex
20755270a4 Debugging version of code 2020-02-24 12:58:13 -05:00
Alex Selimov
3aed6966da Added possibility to select random number within range 2020-02-07 14:38:12 -05:00
Alex Selimov
6f15daf1ec Initial working commit with bug in delete command 2020-02-05 10:57:39 -05:00
Alex Selimov
9be65c4510 Added delete option and update readme 2020-02-04 08:57:24 -05:00
Alex Selimov
58ad74ca9a Quick add of boundary option and update to readme 2020-01-31 11:50:41 -05:00
Alex
64926a4e16 Update to documentation for position specifiers 2020-01-29 09:30:51 -05:00
Alex Selimov
a942b8e2a1 Added -ow option which allows for automatic overwriting 2020-01-28 10:59:49 -05:00
Alex Selimov
38872d8d9f Update to readme with correct format for dislocation command 2020-01-27 20:28:47 -05:00
Alex
347b73054b Added group option and shift command 2020-01-27 10:01:22 -05:00
Alex Selimov
20546dc267 Actual dislocation loop generation algorithm alongside dislgen command 2020-01-13 16:43:49 -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
fb2abc60d1 Updates to box variables adding new sub_box variables and propagating changes through all of the modes 2019-12-07 13:38:52 -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
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
aselimov
552dd3cada
Initial commit 2019-09-25 09:04:36 -04:00