grpp_parameters.c File Reference

#include <assert.h>
#include "grpp_parameters.h"

Go to the source code of this file.

Functions
static int	cartesian_generator_dirac (int L, int *cart_list)
static int	cartesian_generator_turbomole (int L, int *cart_list)
void	libgrpp_set_default_parameters ()
void	libgrpp_set_radial_tolerance (double tolerance)
void	libgrpp_set_angular_screening_tolerance (double tolerance)
void	libgrpp_set_modified_bessel_tolerance (double tolerance)
void	libgrpp_set_cartesian_order (int order)
void	libgrpp_set_cartesian_generator (int(*cartesian_generator)(int L, int *cart_list))

Variables
libgrpp_parameters_t	libgrpp_params

Function Documentation

cartesian_generator_dirac()

int cartesian_generator_dirac ( int L, int * cart_list )

static

Definition at line 86 of file grpp_parameters.c.

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cartesian_generator_turbomole()

int cartesian_generator_turbomole ( int L, int * cart_list )

static

Definition at line 106 of file grpp_parameters.c.

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libgrpp_set_default_parameters()

void libgrpp_set_default_parameters

(

)

Definition at line 33 of file grpp_parameters.c.

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libgrpp_set_radial_tolerance()

void libgrpp_set_radial_tolerance

(

double

tolerance

)

Definition at line 43 of file grpp_parameters.c.

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libgrpp_set_angular_screening_tolerance()

void libgrpp_set_angular_screening_tolerance

(

double

tolerance

)

Definition at line 50 of file grpp_parameters.c.

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libgrpp_set_modified_bessel_tolerance()

void libgrpp_set_modified_bessel_tolerance

(

double

tolerance

)

Definition at line 57 of file grpp_parameters.c.

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libgrpp_set_cartesian_order()

void libgrpp_set_cartesian_order

(

int

order

)

Definition at line 64 of file grpp_parameters.c.

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libgrpp_set_cartesian_generator()

void libgrpp_set_cartesian_generator

(

int(*

cartesian_generator )(int L, int *cart_list)

)

Definition at line 78 of file grpp_parameters.c.

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Variable Documentation

libgrpp_params

libgrpp_parameters_t libgrpp_params

Initial value:

= {
    
    1e-16,
    
    1e-16,
    
    
    1e-16,
    
    cartesian_generator_dirac}

Definition at line 22 of file grpp_parameters.c.