XCDistributorGga< Matrix > Struct Template Reference

distributes a GGA-type xc potential over the XC-matrix elements. More...

#include <xc_evaluators.h>

List of all members.

Static Public Member Functions
static void	distribute (DftIntegratorBl *grid, int bllen, int blstart, int blend, real *restrict tmp, const real *dR, const real *dZ, Matrix &excmat)

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Detailed Description

template<typename Matrix>
struct XCDistributorGga< Matrix >

distributes a GGA-type xc potential over the XC-matrix elements.

Matrix is a type provides an operation add(row, col, val).

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Member Function Documentation

template<typename Matrix >

static void XCDistributorGga< Matrix >::distribute	(	DftIntegratorBl *	grid,
		int	bllen,
		int	blstart,
		int	blend,
		real *restrict	tmp,
		const real *	dR,
		const real *	dZ,
		Matrix &	excmat
	)			[inline, static]

References DftIntegratorBl_::atv, DftIntegratorBl_::bas_bl_cnt, BASBLOCK, DftIntegratorBl_::g, DftIntegratorBl_::nbast, and DftIntegratorBl_::rad.

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

• source/dft/xc_evaluators.h