Generally Applicable Atomic-Charge Dependent London Dispersion Correction
computational-chemistry
quantum-chemistry
ase
pyscf
dispersion-correction
qcschema
fortran-package-manager
-
Updated
Mar 27, 2024 - Fortran
Generally Applicable Atomic-Charge Dependent London Dispersion Correction
reimplementation of the DFT-D3 program
Tactic MMIC translator for QCSchema/MMSchema
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