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5 repositories

tad-dftd3-feedstock
Public
A conda-smithy repository for tad-dftd3.
BSD 3-Clause "New" or "Revised" License
•3•0•0•0•Updated Apr 23, 2026Apr 23, 2026
dftd3-python-feedstock
Public
A conda-smithy repository for dftd3-python.
Shell
•
BSD 3-Clause "New" or "Revised" License
•5•0•0•0•Updated Apr 23, 2026Apr 23, 2026
simple-dftd3-feedstock
Public
A conda-smithy repository for simple-dftd3.
Shell
•
BSD 3-Clause "New" or "Revised" License
•4•0•0•0•Updated Apr 23, 2026Apr 23, 2026
tad-dftd3
Public
PyTorch Autodiff DFT-D3 Implementation.
automatic-differentiation pytorch quantum-chemistry
automatic-differentiation pytorch quantum-chemistry dispersion-correction
Python
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Apache License 2.0
•9•25•2•1•Updated Apr 20, 2026Apr 20, 2026
simple-dftd3
Public
Library first implementation of the D3 dispersion correction
computational-chemistry quantum-chemistry ase
computational-chemistry quantum-chemistry ase pyscf dispersion-correction qcschema
Fortran
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GNU Lesser General Public License v3.0
•35•80•12•3•Updated Apr 15, 2026Apr 15, 2026

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