CFOUR_INTEGRALS¶
This keyword defines what type of integral input will be written by
xjoda
. VMOL (=1) has to be used with the programs of CFOUR. Using ARGOS (=0), input for Pitzer’s ARGOS integral program will be written. (Default: VMOL).
Type: string
Possible Values: VMOL, ARGOS
Default: VMOL