scf.h File Reference

#include "keyval.h"
#include "mpqc/chemistry/qc/lcao/scf/linkage.h"
#include "mpqc/chemistry/qc/lcao/scf/rhf.h"
#include "python.h"
#include "tiledarray.h"
#include "wfn.h"

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Namespaces
	mpqc
	The top-level namespace for all Massively Parallel Quantum Chemistry package.
	mpqc::python
	mpqc::python::scf

Typedefs
using	mpqc::python::scf::RHF = mpqc::lcao::RHF< TA::TensorD, TAPolicy >

Functions
std::shared_ptr< RHF >	mpqc::python::scf::make_rhf_keyval (const KeyVal &kv)
std::shared_ptr< RHF >	mpqc::python::scf::make_rhf_args (std::shared_ptr< Molecule > atoms, std::string basis)
template<class Property >
std::shared_ptr< Property >	mpqc::python::scf::evaluate (RHF &rhf, std::shared_ptr< Property > p)
void	mpqc::python::scf::__init__ (py::module m)