Dear PWScf Users In example 01 and 05, there are some input files for calculating the band structure of silicon that I ran them and drew the band structure successfully. But I can not find any information about orbitals (1s, 2s, 2p, ...) in the output files to ascribe them to the bands. How can I find the atomic orbital or molecular orbital origin of each bands by Quantum Espresso. Many Thanks
Truly Yours Koa -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100904/832f5b33/attachment.htm
