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GauXC
GauXC PublicForked from wavefunction91/GauXC
GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, etc) in the Gaussian basis set discretization of Kohn-Sham d…
C++
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nwchem
nwchem PublicForked from nwchemgit/nwchem
NWChem: Open Source High-Performance Computational Chemistry
Fortran
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