38 #ifndef BASIS_FUNC_PAIR_LIST_HEADER 39 #define BASIS_FUNC_PAIR_LIST_HEADER 58 std::vector<basis_func_index_pair_struct> & resultList);
int get_basis_func_pair_list_2el(const BasisInfoStruct &basisInfo, const IntegralInfo &integralInfo, ergo_real threshold, ergo_real maxDensityMatrixElement, std::vector< basis_func_index_pair_struct > &resultList)
Definition: basis_func_pair_list.cc:119
double ergo_real
Definition: realtype.h:69
int index_2
Definition: basis_func_pair_list.h:50
Code for setting up basis functions starting from shells.
Definition: basis_func_pair_list.h:47
Definition of the main floating-point datatype used; the ergo_real type.
Contains coefficients needed for quick integral evaluation.
Definition: integral_info.h:93
Defines IntegralInfo object, providing the coefficients needed for integral evaluation.
Definition: basisinfo.h:112
int index_1
Definition: basis_func_pair_list.h:49