TaeInKim's repositories
dftbplus
DFTB+ general package for performing fast atomistic simulations
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NAST
Nonadiabatic statistical theory package for predicting kinetics of spin-dependent processes
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pyscf
Python module for quantum chemistry
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pySpawn17
A python package for performing full multiple spawning nonadiabatic molecular dynamics simulations
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S-O-MQC-HW
Solutions for Modern Quantum Chemistry, Szabo & Ostlund
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