Internal representation of a basis set. More...

#include <grid_basis_set.h>

Data Fields
int	nset

int	nsgf

int	maxco

int	maxpgf

int *	lmin

int *	lmax

int *	npgf

int *	nsgf_set

int *	first_sgf

double *	sphi

double *	zet

Detailed Description

Internal representation of a basis set.

Author: Ole Schuett

Definition at line 14 of file grid_basis_set.h.

Field Documentation

◆ nset

int grid_basis_set::nset

Definition at line 15 of file grid_basis_set.h.

◆ nsgf

int grid_basis_set::nsgf

Definition at line 16 of file grid_basis_set.h.

◆ maxco

int grid_basis_set::maxco

Definition at line 17 of file grid_basis_set.h.

◆ maxpgf

int grid_basis_set::maxpgf

Definition at line 18 of file grid_basis_set.h.

◆ lmin

int* grid_basis_set::lmin

Definition at line 19 of file grid_basis_set.h.

◆ lmax

int* grid_basis_set::lmax

Definition at line 20 of file grid_basis_set.h.

◆ npgf

int* grid_basis_set::npgf

Definition at line 21 of file grid_basis_set.h.

◆ nsgf_set

int* grid_basis_set::nsgf_set

Definition at line 22 of file grid_basis_set.h.

◆ first_sgf

int* grid_basis_set::first_sgf

Definition at line 23 of file grid_basis_set.h.

◆ sphi

double* grid_basis_set::sphi

Definition at line 24 of file grid_basis_set.h.

◆ zet

double* grid_basis_set::zet

Definition at line 25 of file grid_basis_set.h.

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

grid/common/grid_basis_set.h

Data Fields