integrals_2el_single.h File Reference

Functionality for computing a single 2-electron integral, for two given primitive Gaussian distributions. More...

#include "basisinfo.h"
#include "integrals_hermite.h"

Go to the source code of this file.

Functions
ergo_real	do_2e_integral_using_symb_info (const JK::ExchWeights &CAM_params, const DistributionSpecStruct *psi1, const DistributionSpecStruct *psi2, const IntegralInfo &integralInfo)

Detailed Description

Functionality for computing a single 2-electron integral, for two given primitive Gaussian distributions.

Author

: Elias Rudberg responsible

Function Documentation

do_2e_integral_using_symb_info()

ergo_real do_2e_integral_using_symb_info	(	const JK::ExchWeights &	CAM_params,
		const DistributionSpecStruct *	psi1,
		const DistributionSpecStruct *	psi2,
		const IntegralInfo &	integralInfo )

References do_2e_integral_using_symb_info_h().

Referenced by do_2e_integral_general(), and get_M().