openteamsinc
pypi/pyscf
Risk Profile
Package
Source
Risk Profile
Maturity:
Mature
Health:
Healthy
Legal:
Caution Needed
License includes a patent grant clause
Security:
Healthy
Package
pypi
pyscf
Version
2.13.0
Last Release Date
1 day ago
License
Apache
Dependencies
numpy
!=1.16, !=1.17, >=1.13
scipy
>=1.6.0
h5py
>=2.7
setuptools
forge:
pyscf-forge
geomopt:
pyberny
>=0.6.2
geometric
>=0.9.7.2
pyscf-qsdopt
doci:
pyscf-doci
properties:
pyscf-properties
semiempirical:
pyscf-semiempirical
cppe:
cppe
pyqmc:
pyqmc
bse:
basis-set-exchange
dispersion:
pyscf-dispersion
ccpy:
coupled-cluster-py
all:
pyscf
[bse,ccpy,cppe,dispersion,doci,forge,geomopt,properties,pyqmc,semiempirical]
cornell-shci:
pyscf-cornell-shci
nao:
pyscf-nao
fciqmcscf:
pyscf-fciqmc
tblis:
pyscf-tblis
icmpspt:
pyscf-icmpspt
shciscf:
pyscf-shciscf
Source
Location
pyscf/pyscf
Last Source Update
1 day ago
Licenses
Apache License 2.0
Distribution Destinations
pypi/pyscf
