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orbital_space.h File Reference
#include "mpqc/chemistry/qc/lcao/expression/fwd.h"#include <memory>#include "mpqc/chemistry/qc/lcao/basis/basis.h"#include "mpqc/chemistry/qc/lcao/expression/operator.h"#include "mpqc/chemistry/qc/lcao/expression/orbital_index.h"#include "mpqc/math/groups/group.h"#include "mpqc/util/core/exception.h"
Include dependency graph for orbital_space.h:
This graph shows which files directly or indirectly include this file:
Classes | |
| class mpqc::lcao::OrbitalSpace< Array > | |
| OrbitalSpace represents a set of LCAO. More... | |
| class mpqc::lcao::OrbitalSpace< Array >::Provider | |
| class mpqc::lcao::DecoratedOrbitalSpace< Array, OrbitalAttribute, AttributeTag > | |
| an OrbitalSpace where each orbital in addition to irrep has additional attributes More... | |
| class mpqc::lcao::DecoratedOrbitalSpace< Array, OrbitalAttribute, AttributeTag >::Provider | |
| struct mpqc::lcao::detail::AttributeTag< tag > | |
Namespaces | |
| mpqc | |
| The top-level namespace for all Massively Parallel Quantum Chemistry package. | |
| mpqc::lcao | |
| mpqc::lcao::detail | |
Typedefs | |
| using mpqc::lcao::detail::CanonicalAttributeTag = AttributeTag< 0 > | |
| using mpqc::lcao::detail::PopulatedAttributeTag = AttributeTag< 1 > | |
| template<typename Array > | |
| using mpqc::lcao::CanonicalOrbitalSpace = DecoratedOrbitalSpace< Array, double, detail::CanonicalAttributeTag > | |
| template<typename Array > | |
| using mpqc::lcao::PopulatedOrbitalSpace = DecoratedOrbitalSpace< Array, double, detail::PopulatedAttributeTag > | |
| Populated orbitals are decorated by occupancies, no order assumed. More... | |
