#include <meta_op.h>

Collaboration diagram for hamilt::meta_pw_op< FPTYPE, Device >:

Public Member Functions
void	operator() (const Device dev, const int &ik, const int &pol, const int &npw, const int &npwx, const FPTYPE &tpiba, const FPTYPE gcar, const FPTYPE kvec_c, const std::complex< FPTYPE > in, std::complex< FPTYPE > *out, const bool add=false)
	Compute the metaGGA potential of hPsi in recip space, out = hpsi * (wfcpw->gcar+wfcpw->kvec_c) * this->tpiba;.

Member Function Documentation

◆ operator()()

template<typename FPTYPE , typename Device >

void hamilt::meta_pw_op< FPTYPE, Device >::operator()	(	const Device *	dev,
		const int &	ik,
		const int &	pol,
		const int &	npw,
		const int &	npwx,
		const FPTYPE &	tpiba,
		const FPTYPE *	gcar,
		const FPTYPE *	kvec_c,
		const std::complex< FPTYPE > *	in,
		std::complex< FPTYPE > *	out,
		const bool	add = `false`
	)

Compute the metaGGA potential of hPsi in recip space, out = hpsi * (wfcpw->gcar+wfcpw->kvec_c) * this->tpiba;.

Input Parameters

Parameters

dev	: the type of computing device
ik	: current k point
pol	: loop of [0, 1, 2]
npw	: number of planewaves of current k point
npwx	: number of planewaves of all k points
tpiba	: ucell.tpiba
gcar	: wfcpw->gcar
kvec_c	: wfcpw->kvec_c
in	: input hpsi
bool	: conditional flag

Output Parameters

Parameters

out	: output array with size of nspin * npwx

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

/home/runner/work/abacus-develop/abacus-develop/source/source_pw/module_pwdft/kernels/meta_op.h