ergo
|
#include <integral_info.h>
Public Member Functions | |
ExchWeights () | |
Public Attributes | |
ergo_real | alpha |
ergo_real | beta |
ergo_real | mu |
int | computeRangeSeparatedExchange |
shortcut for |beta| != 0 |
JK::ExchWeights::ExchWeights | ( | ) | [inline] |
Referenced by ErgoE2Evaluator::transform(), compute_2e_matrix_list(), get_related_integrals_hermite(), SCF_general::SCF_general(), get_2e_matrix_and_energy_simple_sparse(), get_2e_matrices_and_energy_simple_sparse_unrestricted(), get_2e_matrix_and_energy_sparse(), get_2e_matrices_and_energy_sparse_unrestricted(), and get_2e_matrices_and_energy_restricted_open().
Referenced by ErgoE2Evaluator::transform(), get_related_integrals_hermite(), and SCF_general::SCF_general().
shortcut for |beta| != 0
Referenced by ErgoE2Evaluator::transform(), compute_2e_matrix_list(), get_related_integrals_hermite(), SCF_general::SCF_general(), get_2e_matrix_and_energy_simple_sparse(), get_2e_matrices_and_energy_simple_sparse_unrestricted(), get_2e_matrix_and_energy_sparse(), get_2e_matrices_and_energy_sparse_unrestricted(), and get_2e_matrices_and_energy_restricted_open().
Referenced by ErgoE2Evaluator::transform(), get_related_integrals_hermite(), and SCF_general::SCF_general().