does not throw an error, but I cannot find any results under oeprop.Exvals(), oeprop.Eyvals(), oeprop.Ezvals(), or oeprop.Vvals() and I do not see any files written to disk.
I’d be grateful if somebody could point me towards what I’m doing wrong.
Thank you very much for the quick reply (and all your past replies, for that matter)! I forgot to include return_wfn=True when retyping the commands, thanks for pointing that out. And yes, I’m using version 1.3.2. I couldn’t find instructions on how to access PSI variables in the Python API.
I think I don’t understand what you mean with this relating to oeprop.Exvals(), could you please elaborate?
Also note that in future versions of PSI4 we are switching to wfn.variables(), i.e. variables are local to the wfn object. The psi4.core.variables() are sort of global will be overwrritten if a second calculation is run.