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conda-forge / packages / pyscf-dispersion 1.3.0

0

A collection of DFTD3 and DFTD4 with PySCF support

copied from cf-post-staging / pyscf-dispersion

License: Apache-2.0
Home: https://github.com/pyscf/dispersion
17786 total downloads
Last upload: 5 months and 5 hours ago

Installers

linux-64 v1.3.0
osx-64 v1.3.0
osx-arm64 v1.3.0
linux-ppc64le v1.3.0
linux-aarch64 v1.3.0

conda install

To install this package run one of the following:
conda install conda-forge::pyscf-dispersion

Description

"OpenMP is disabled in both DFTD3 and DFTD4"

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