Brandon Eskridge

icon company Flatiron Institute icon location New York, NY icon location Computational scientist with a PhD in physics, currently working in theoretical quantum chemistry / condensed matter physics.

Results 2 comments of Brandon Eskridge

Fix incorrect parsing of FCIDUMP with complex-valued integrals

Thanks for the quick response. I suppose you're right. The general FCIDUMP format doesn't specify how to handle complex-valued integrals, it's just `X a b c d` where `X` can...

Fix incorrect parsing of FCIDUMP with complex-valued integrals

Hi @ndattani, no my modifiaction is no longer necessary! It is perfectly safe to close this PR without merging. Thank you very much for following up.