[Pw_forum] ibrav=8

Dai Jun jdai3 at mail.ustc.edu.cn
Sat Feb 12 15:05:20 CET 2011


Dear Hazrati,
take a look at http://www.cryst.ehu.es/cryst/get_kvec.html;
choose the space group, and then you can see the k-vectors.

Best regards,

2011-02-12 



Jun DAI
Room3016, Hefei National Laboratory for Physical Sciences at the Microscale
University of Science & Technology of China
Hefei, Anhui 230026, P.R. China
Tel. :+86-551-3606428



发件人: Mehrnoosh Hazrati 
发送时间: 2011-02-12  21:51:36 
收件人: pw_forum 
抄送: 
主题: [Pw_forum] ibrav=8 
 
Dear QE users,

I want to calculate the band structures for a orthorhombic P lattice ( ibrav=8 ), which K-point set should i choose ?

best regards,
Mehrnoosh
-------------- next part --------------
An HTML attachment was scrubbed...
URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110212/cdf97af9/attachment.htm 


More information about the Pw_forum mailing list