gbasis
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Getting Started
Install
Python Interface
Gaussian basis sets
Computing an integral involving the electron density
Constructing a one-body operator from a real-space potential
Developing on GBasis
Publishing Contributions
Python API
gbasis package
Subpackages
gbasis.test package
Submodules
gbasis.cext module
gbasis.gobasis module
gbasis.iobas module
gbasis.periodic module
gbasis.utils module
Module contents
C++ Backend API
gbasis
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Python API
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gbasis package
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gbasis package
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Subpackages
¶
gbasis.test package
Submodules
gbasis.test.cext module
gbasis.test.common module
gbasis.test.gobasis_data module
gbasis.test.lightgrid module
gbasis.test.mol_data module
Module contents
Submodules
¶
gbasis.cext module
gbasis.gobasis module
gbasis.iobas module
gbasis.periodic module
gbasis.utils module
Module contents
¶
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