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Search results for quantum chemistry dispersion correction
dispersion-correction
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quantum-chemistry
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5 search results found
Dftd4
⭐
136
Generally Applicable Atomic-Charge Dependent London Dispersion Correction
Simple Dftd3
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41
reimplementation of the DFT-D3 program
Tad Dftd3
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6
PyTorch Autodiff DFT-D3 Implementation.
Cpp D4
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6
C++ port of DFT-D4
Tad Dftd4
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6
PyTorch Autodiff DFT-D4 Implementation.
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1-5 of 5 search results
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