Hi all!
Can PSI4 currently do EOM-CCSD oscillator strengths with open shell references? Seems like it should be able to if it can do analytic first derivatives.
However, the job is failing after SCF convergence:
Traceback (most recent call last):
File “/home/ndyonker/bin/psi4/bin/bin/psi4”, line 260, in
exec(content)
File “”, line 52, in
TypeError: ‘properties’ is an invalid keyword argument for this function
Do I need an energy call before I do this?
property(‘eom-ccsd’, properties=[‘oscillator_strength’])
Rollin,
Lori’s initial suggestion of browsing the test suite for proper syntax did the trick. Calculations are running smoothly! Glad I could help y’all find some code that needs tidying.