integrals_1el_single.h File Reference

#include "basisinfo.h"

Go to the source code of this file.

Functions
ergo_real	do_1e_repulsion_integral_using_symb_info (DistributionSpecStruct *psi, ergo_real pointCharge, const ergo_real *pointChargeCoords, const IntegralInfo *b)
ergo_real	do_1e_repulsion_integral_list_using_symb_info (DistributionSpecStruct *psi, const ergo_real *pointChargeList, const ergo_real *pointChargeCoordsList, int noOfPointCharges, const IntegralInfo *b)

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Function Documentation

ergo_real do_1e_repulsion_integral_list_using_symb_info	(	DistributionSpecStruct *	psi,
		const ergo_real *	pointChargeList,
		const ergo_real *	pointChargeCoordsList,
		int	noOfPointCharges,
		const IntegralInfo *	b
	)

ergo_real do_1e_repulsion_integral_using_symb_info	(	DistributionSpecStruct *	psi,
		ergo_real	pointCharge,
		const ergo_real *	pointChargeCoords,
		const IntegralInfo *	b
	)

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