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xc_data Struct Reference

Public Attributes

const real * dmat
const BasisInfoStruct * bis
const Molecule * mol
const Dft::GridParams * gss
real * xc
real edfty
real el
int nElectrons
int nThreads

Member Data Documentation

◆ bis

const BasisInfoStruct* xc_data::bis

Referenced by dft_get_xc_mt(), and dft_get_xc_worker().

◆ dmat

const real* xc_data::dmat

Referenced by dft_get_xc_mt(), and dft_get_xc_worker().

◆ edfty

real xc_data::edfty

Referenced by dft_get_xc_mt(), and dft_get_xc_worker().

◆ el

real xc_data::el

Referenced by dft_get_xc_worker().

◆ gss

const Dft::GridParams* xc_data::gss

Referenced by dft_get_xc_mt(), and dft_get_xc_worker().

◆ mol

const Molecule* xc_data::mol

Referenced by dft_get_xc_mt(), and dft_get_xc_worker().

◆ nElectrons

int xc_data::nElectrons

Referenced by dft_get_xc_mt(), and dft_get_xc_worker().

◆ nThreads

int xc_data::nThreads

Referenced by dft_get_xc_worker().

◆ xc

real* xc_data::xc

Referenced by dft_get_xc_mt(), and dft_get_xc_worker().

The documentation for this struct was generated from the following file: