CFOUR_SCF_EXTRAPOLATION¶
Specifies whether or not the DIIS extrapolation is used to accelerate convergence of the SCF procedure. OFF (=0) means do not use DIIS, ON (=1) means use DIIS.
Type: boolean
Default: true
Specifies whether or not the DIIS extrapolation is used to accelerate convergence of the SCF procedure. OFF (=0) means do not use DIIS, ON (=1) means use DIIS.
Type: boolean
Default: true