Large Single Crystal Maker v1.2
Compile
$ makeUsage: ./LSCM [-p c] [-f] [-b] [-d] [-n] [-a lattice_constant] [-r file.data] -x nx -y ny -z nz [--cfg] [--custom] [--data] -o output
Example: ./LSCM -f -a 3.615 -x 50 -y 50 -z 50 -o singleCu.custom
Example: ./LSCM -p 5.21033 -a 3.20927 -x 30 -y 50 -z 30 --cfg -o singleMg.cfg
-s, Spherical shape
-f, FCC
-b, BCC
-d, Diamond
-n, Nacl
-r, Read and replicate
-o, outputfile
-h, print help
--cfg, output in .cfg format
--custom, output in LAMMPS .custom format
--data, output in .data format
- Fork it!
- Create your feature branch:
git checkout -b my-new-feature - Commit your changes:
git commit -am 'Add some feature' - Push to the branch:
git push origin my-new-feature - Submit a pull request :D