Posted by Yonaton Heit on May 14, 2018 at 16:48:35:
I am a trying to run a CASPT2 calculation on complex solvated by C-PCM. I'm including the RFPErt keyword as the manual suggests but I keep getting the error message.
Location: get_dScalar
Data not defined RF Self Energy
I have no issue when I use my JobIph file on using the RASSI module. CASPT2 is the only problem. I am using version 8.2.