Dear friends, can anyone give me some theoretical detais about non collinear calculation using pwscf? i have checked example 13 and also a note by Ralph Gebauer but didnt quite understand some points like "penalty functional"; how to set its value. it will be great help for me if anybody can provide me some reference on that thnx -- Rudra JRF A bus station is where a bus stops. A train station is where a train stops. On my desk I have a work station. http://www.bose.res.in/~rudra Please, if possible, don't send me MS Word or PowerPoint attachments Why?See: http://www.gnu.org/philosophy/no-word-attachments.html
5, 50, 500, 5000 - Store N number of mails in your inbox. Go to http://help.yahoo.com/l/in/yahoo/mail/yahoomail/tools/tools-08..html -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20080324/b78e9c31/attachment.htm