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