denom.h File Reference
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Namespaces | |
mpqc | |
The top-level namespace for all Massively Parallel Quantum Chemistry package. | |
mpqc::lcao | |
mpqc::lcao::detail | |
Functions | |
template<typename Tile , typename Policy > | |
void | mpqc::lcao::detail::d_abij_inplace (TA::Array< double, 4, Tile, Policy > &abij, const EigenVector< typename Tile::numeric_type > &ens, std::size_t n_occ, std::size_t n_frozen, typename Tile::numeric_type shift=0.0) |
template<typename Tile , typename Policy , typename EigenVectorX = Eigen::Matrix<typename Tile::element_type, Eigen::Dynamic, 1>> | |
TA::DistArray< Tile, Policy > | mpqc::lcao::detail::d_abcijk (TA::DistArray< Tile, Policy > &abcijk, const EigenVectorX &ens, std::size_t n_occ, std::size_t n_frozen) |
template<typename Tile , typename Policy > | |
TA::DistArray< Tile, Policy > | mpqc::lcao::detail::d_abij (const TA::DistArray< Tile, Policy > &abij, const EigenVector< typename Tile::numeric_type > &ens, std::size_t n_occ, std::size_t n_frozen, typename Tile::numeric_type shift=0.0) |
template<typename Tile , typename Policy > | |
TA::DistArray< Tile, typename std::enable_if< std::is_same< Policy, TA::SparsePolicy >::value, TA::SparsePolicy >::type > | mpqc::lcao::detail::create_d_ai (madness::World &world, const TA::TiledRange &trange, const EigenVector< typename Tile::numeric_type > ens, std::size_t n_occ, std::size_t n_frozen) |
template<typename Tile , typename Policy > | |
TA::DistArray< Tile, typename std::enable_if< std::is_same< Policy, TA::DensePolicy >::value, TA::DensePolicy >::type > | mpqc::lcao::detail::create_d_ai (madness::World &world, const TA::TiledRange &trange, const Eigen::VectorXd &ens, std::size_t n_occ, std::size_t n_frozen) |