esigen icon indicating copy to clipboard operation
esigen copied to clipboard

Published 20 hours ago • verified publisher icon insilichem

Update ccData subclass

Open jaimergp opened this issue 7 years ago • 1 comments

cclib 1.6 includes some of the fields we were adding in the subclass. Remove those and update requirements.

jaimergp avatar Sep 05 '18 14:09 jaimergp

Partially addressed in commit 0743d887f4aad95f602c1ca803f7f9646c5a6e0d.

I'll keep this issue open to reflect changes when new properties (alpha and beta electrons) are merged in cclib.

jaimergp avatar Sep 08 '18 09:09 jaimergp