Set the offset of the adaptive shift equal to the eigen energy(s) of the trial space. @param[in] nexcit_keep number of wave functions/energies kept during trial-wf initialization @param[in] replica_pairs whether replicas are assumed to be paired during trial-wf initialization
Type | Intent | Optional | Attributes | Name | ||
---|---|---|---|---|---|---|
integer, | intent(in) | :: | nexcit_keep | |||
logical, | intent(in) | :: | replica_pairs |