I am trying to calculate transition dipole moment derivatives using Turbomole 7.3. For some reason, and although I think I included the neccessary keywords to perform such a calculation, they are not found in the output, maybe beause an instruction is not properly written or is missing.
This are the keywords I included in the control file:
$denconv - flag $excitations irrep=a multiplicity= 1 nexc= 3 npre= 1 nstart= 1 exprop states=all relaxed operators=xdiplen,ydiplen,zdiplen spectrum states=all operators=xdiplen,ydiplen,zdiplen momdrv states=all operators=xdiplen,ydiplen,zdiplen $response fop relaxed $ricc2 adc(2) maxiter = 100 $cbas file=auxbasis
I have checked the excited state file and also the output one, but only the transition dipole moments are written, not the derivatives.
Does anyone know how to solve this problem? Thank you