28 #ifndef INTEGRALS_1EL_SINGLE_HEADER 29 #define INTEGRALS_1EL_SINGLE_HEADER double ergo_real
Definition: realtype.h:53
std::vector< ergo_real > do_1e_repulsion_integral_derivatives_using_symb_info(const DistributionSpecStruct *psi, ergo_real pointCharge, const ergo_real *pointChargeCoords, const IntegralInfo &integralInfo)
Definition: integrals_1el_single.cc:102
ergo_real do_1e_repulsion_integral_using_symb_info(DistributionSpecStruct *psi, ergo_real pointCharge, const ergo_real *pointChargeCoords, const IntegralInfo &integralInfo)
Definition: integrals_1el_single.cc:178
ergo_real do_1e_repulsion_integral_list_using_symb_info(DistributionSpecStruct *psi, const ergo_real *pointChargeList, const ergo_real *pointChargeCoordsList, int noOfPointCharges, const IntegralInfo &integralInfo)
Contains coefficients needed for quick integral evaluation.
Definition: integral_info.h:81
Definition: basisinfo.h:43