9 Commits (53b3d378c42ff15816c9c90e85139f067216b600)

Author SHA1 Message Date
Aditya Wibawa Sakti 0ded9d1126 bug fix for DCDFTB 11 months ago
Aditya Wibawa Sakti 50197aaf02 fix bug with the temperature in -s gromacs 1 year ago
Aditya Wibawa Sakti 0564066980 update 1 year ago
Aditya Wibawa Sakti 2e296b4997 Modified DCDFTBMD 2 years ago
Aditya Wibawa Sakti 54e5e463a3 modreadme 2 years ago
Nova Pratiwi Indriyani 8032b6879d update 2 years ago
Aditya Wibawa Sakti be5cb3dce0 add XTB1 to the DFTB+ module 2 years ago
Aditya Wibawa Sakti 500f7c3fd1 added non-slurm calculations 2 years ago
adit 322ddc4ad6 mod README 2 years ago