SHARC

Surface Hopping including Arbitrary Couplings developed by the González group

Vienna

Pinned Repositories

sharc
The SHARC molecular dynamics (MD) program suite is an ab initio MD software package developed to study the excited-state dynamics of molecules.
Language:Python63 14 10234
sharc_cobramm_interface
Files to run QM/MM trajectory surface hopping interfacing the SHARC and COBRAMM program package
Language:Python3 1 00

SHARC's Repositories

sharc-md/sharc
The SHARC molecular dynamics (MD) program suite is an ab initio MD software package developed to study the excited-state dynamics of molecules.
Language:Python63 14 10234
sharc-md/sharc_cobramm_interface
Files to run QM/MM trajectory surface hopping interfacing the SHARC and COBRAMM program package
Language:Python3 1 00