dftefe::atoms::AtomSphDataPSPDefaults Class Reference

#include <Defaults.h>

Static Public Attributes
static const std::map< std::string, std::string >	UPF_PARENT_PATH_LOOKUP
static const std::vector< std::string >	METADATANAMES

Member Data Documentation

METADATANAMES

const std::vector< std::string > dftefe::atoms::AtomSphDataPSPDefaults::METADATANAMES

static

Initial value:

{
      "element",
      "z_valence",
      "l_max",
      "number_of_wfc",
      "number_of_proj",
      "core_correction",
      "dij"}

UPF_PARENT_PATH_LOOKUP

const std::map< std::string, std::string > dftefe::atoms::AtomSphDataPSPDefaults::UPF_PARENT_PATH_LOOKUP

static

Initial value:

{
        {"r", "PP_MESH"}, 
        {"vlocal", "PP_LOCAL"},
        {"beta", "PP_NONLOCAL"},
        {"pswfc", "PP_PSWFC"},
        {"nlcc", "PP_NLCC"},
        {"rhoatom", "PP_RHOATOM"}}

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The documentation for this class was generated from the following files:

• src/atoms/Defaults.h
• src/atoms/Defaults.cpp