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Author:
None
License:
Apache-2.0
Summary:
PySCF: Python-based Simulations of Chemistry Framework
Latest version:
2.11.0
Required dependencies:
h5py
|
numpy
|
scipy
|
setuptools
Optional dependencies:
basis-set-exchange
|
coupled-cluster-py
|
cppe
|
geometric
|
pyberny
|
pyqmc
|
pyscf
|
pyscf-cornell-shci
|
pyscf-dispersion
|
pyscf-doci
|
pyscf-fciqmc
|
pyscf-forge
|
pyscf-icmpspt
|
pyscf-nao
|
pyscf-properties
|
pyscf-qsdopt
|
pyscf-semiempirical
|
pyscf-shciscf
|
pyscf-tblis
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