[Pw_forum] homo and lumo

zahra krim zahrakrim at outlook.fr
Sun Feb 12 16:35:56 CET 2017


Dear,

I am a beginner student with  quantum espresso code, I would like to study the boundary orbitals of the molecule of CO, I would be grateful if anyone can help me to show the steps to follow in order to study the HOMO and LUMO of carbon monoxide;

Cordially
K.zahra
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20170212/6187e6d8/attachment.html>


More information about the users mailing list