Dear all I have a problem I set alat=7.40 7.41 7.42 7.43 7.44 7.45 7.46 7.47 7.48 7.49 7.50 and I vary clat=1.005 1.010 1.015 1.020 1.025 1.030 1.035 1.040 1.045 1.050 1.055 1.060 1.065 when alat increase clat decrease to neary perfect cubic How I must be going the problem
Abdulmutta I am alone > From: pw_forum-request at pwscf.org > Subject: Pw_forum Digest, Vol 30, Issue 23 > To: pw_forum at pwscf.org > Date: Sat, 12 Dec 2009 09:00:38 +0100 > > Send Pw_forum mailing list submissions to > pw_forum at pwscf.org > > To subscribe or unsubscribe via the World Wide Web, visit > http://www.democritos.it/mailman/listinfo/pw_forum > or, via email, send a message with subject or body 'help' to > pw_forum-request at pwscf.org > > You can reach the person managing the list at > pw_forum-owner at pwscf.org > > When replying, please edit your Subject line so it is more specific > than "Re: Contents of Pw_forum digest..." > > > Today's Topics: > > 1. Preference of impurity (Padmaja Patnaik) > > > ---------------------------------------------------------------------- > > Message: 1 > Date: Fri, 11 Dec 2009 20:17:00 +0000 (GMT) > From: Padmaja Patnaik <padmaja_patnaik at yahoo.co.uk> > Subject: [Pw_forum] Preference of impurity > To: pw_forum at pwscf.org > Message-ID: <884255.16332.qm at web26105.mail.ukl.yahoo.com> > Content-Type: text/plain; charset="utf-8" > > Dear all > > My query is not related to Quantum-espresso code, as it is supposed to be in > this forum. I want to know which impurities are preferred for a semiconductor > for practical use, those creating a shallow level or those creating a deep > level ? I would also like to know any material which can give me details of > this information. > Thanks in advance. > > Regards > Padmaja Patnaik > > Research Scholar > > Dept of Physics > > IIT Bombay > > Mumbai, India > > > > -------------- next part -------------- > An HTML attachment was scrubbed... > URL: > http://www.democritos.it/pipermail/pw_forum/attachments/20091211/990e438f/attachment.html > > > ------------------------------ > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > > > End of Pw_forum Digest, Vol 30, Issue 23 > **************************************** _________________________________________________________________ Windows Live Hotmail: ?????????????????????????????? Facebook ????????????????? Hotmail? http://www.microsoft.com/windows/windowslive/see-it-in-action/social-network-basics.aspx?ocid=PID23461::T:WLMTAGL:ON:WL:th-th:SI_SB_4:092009 -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20091212/27bed8e3/attachment.htm
