sd.impl.ipp File Reference
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Namespaces

 mpqc
 The top-level namespace for all Massively Parallel Quantum Chemistry package.
 
 mpqc::lcao
 
 mpqc::lcao::pbc
 import the gaussian::utility namespace into the pbc::gaussian namespace
 

Macros

#define MPQC4_SRC_MPQC_CHEMISTRY_QC_SCF_PBC_SD_IPP_
 

Functions

template<typename... Args>
auto mpqc::lcao::pbc::initial_guess (const KeyVal &kv, pbc::gaussian::AOFactory< Args... > &ao_factory)
 
void mpqc::lcao::pbc::chop_phase (MatrixZ &mat, double tolerance=std::numeric_limits< double >::epsilon())
 

Macro Definition Documentation

◆ MPQC4_SRC_MPQC_CHEMISTRY_QC_SCF_PBC_SD_IPP_

#define MPQC4_SRC_MPQC_CHEMISTRY_QC_SCF_PBC_SD_IPP_