xc_data Struct Reference

List of all members.

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

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Member Data Documentation

const BasisInfoStruct* xc_data::bis

const real* xc_data::dmat

real xc_data::edfty

real xc_data::el

const Dft::GridParams* xc_data::gss

const Molecule* xc_data::mol

int xc_data::nElectrons

int xc_data::nThreads

real* xc_data::xc

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

• source/dft/xc_matrix.cc

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