DMRG_CASPT2_ORBS¶
Whether to calculate the DMRG-CASPT2 energy after the DMRGSCF calculations are done.
Type: string
Possible Values: PSEUDOCANONICAL, ACTIVE
Default: PSEUDOCANONICAL
Whether to calculate the DMRG-CASPT2 energy after the DMRGSCF calculations are done.
Type: string
Possible Values: PSEUDOCANONICAL, ACTIVE
Default: PSEUDOCANONICAL