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util.h File Reference
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Classes | |
struct mpqc::detail::scalar_type< double > | |
struct mpqc::detail::scalar_type< float > | |
struct mpqc::detail::scalar_type< std::complex< T > > | |
Namespaces | |
mpqc | |
The top-level namespace for all Massively Parallel Quantum Chemistry package. | |
mpqc::detail | |
Typedefs | |
template<typename T > | |
using mpqc::detail::scalar_t = typename scalar_type< T >::type | |
Functions | |
void mpqc::detail::sort_eigen (VectorZ &eigVal, MatrixZ &eigVec) | |
This sorts eigenvalues and eigenvectors in ascending order of the real parts of eigenvalues. More... | |
template<typename Numeric > | |
Numeric mpqc::detail::canonical_phase_inverse (const Numeric &value) | |
template<typename _Numeric , int _Rows, int _Cols, int _Options, int _MaxRows, int _MaxCols> | |
auto mpqc::detail::canonical_column_phase (Eigen::Matrix< _Numeric, _Rows, _Cols, _Options, _MaxRows, _MaxCols > &matrix, std::vector< Eigen::Index > *pd_element_rowidx_ptr=nullptr, scalar_t< _Numeric > comparison_tolerance=std::numeric_limits< scalar_t< _Numeric >>::epsilon()) | |
Canonicalizes column phases. More... | |
template<typename _Scalar , int _Rows, int _Cols, int _Options, int _MaxRows, int _MaxCols> | |
auto mpqc::detail::format_commainit (const Eigen::Matrix< _Scalar, _Rows, _Cols, _Options, _MaxRows, _MaxCols > &matrix, int precision=-1, bool align_cols=true) | |
template<typename _Scalar , int _Rows, int _Cols, int _Options, int _MaxRows, int _MaxCols> | |
void mpqc::detail::write_commainit (std::ostream &os, const Eigen::Matrix< _Scalar, _Rows, _Cols, _Options, _MaxRows, _MaxCols > &matrix, const std::string name="matrix", int precision=-1, bool align_cols=true) | |
template<typename _Scalar , int _Rows, int _Cols, int _Options, int _MaxRows, int _MaxCols> | |
auto mpqc::detail::format_cpp (const Eigen::Matrix< _Scalar, _Rows, _Cols, _Options, _MaxRows, _MaxCols > &matrix) | |