
OCC_TOLERANCEΒΆ
Cutoff for occupation of MP2 NO orbitals in FNO-QCISD/CCSD(T) ( only valid if NAT_ORBS = true )
- Type: conv double
- Default: 1.0e-6
Cutoff for occupation of MP2 NO orbitals in FNO-QCISD/CCSD(T) ( only valid if NAT_ORBS = true )
- Type: conv double
- Default: 1.0e-6