DMRG_ACTIVE_SPACE
Which active space to use for DMRG calculations: –> input with SCF rotations (INPUT); –> natural orbitals (NO); –> localized and ordered orbitals (LOC) Type: string Possible Values: INPUT, NO, LOC Default: INPUT
Which active space to use for DMRG calculations: –> input with SCF rotations (INPUT); –> natural orbitals (NO); –> localized and ordered orbitals (LOC)
DMRG
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