Dear apsi Thank you very much for your help. I am attaching .jpg file of Alpha-Ga structure and also the article which I am following for this structure. Yes, the number of iterations are large than required. Thanks for pointing this out.
Thank you Manjusha -- Manjusha Research Scholar C/O Dr. Madhav Ranganathan Department of Chemistry Indian Institute of Technology,Kanpur U.P., India 208016 Lab-SL302 ph:+91-512-259 6539 -------------- next part -------------- A non-text attachment was scrubbed... Name: AlphaGa.jpg Type: image/jpeg Size: 20156 bytes Desc: not available Url : http://pwscf.org/pipermail/pw_forum/attachments/20140307/5dc04c7a/attachment.jpg
