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occ::qm::PointChargeMethod Concept Reference

#include <scf_method.h>

Concept definition

template<typename T>
SCFMethod<T> && requires(T method, const PointChargeList &charges) {
{
method.nuclear_point_charge_interaction_energy(charges)
} -> std::same_as<double>;
{
method.compute_point_charge_interaction_matrix(charges)
} -> std::same_as<Mat>;
}
Definition scf_method.h:42
Definition scf_method.h:16
std::vector< occ::core::PointCharge > PointChargeList
Definition hf.h:15