Open ajm143 opened 5 years ago
Mizoguchi is a written up python script that can be wrapped into optadpydos I think but It would also be nice to add into optados the ability to add a keyword mizoguchi : 1234 eV so that it just uses that to calculate.
I have attached what I wrote for calculating the transition energy since that seemed to be the part of the manual that was missing for me, but the rest of it is there.
E_TE.pdf