<div>Dear Ricardo,</div> <div>Thanks a lot for your reply.</div> <div>Best wishes,</div> <div>Rahnama<BR><BR><B><I>Ricardo Faccio <rfaccio@fq.edu.uy></I></B> wrote:</div> <BLOCKQUOTE class=replbq style="PADDING-LEFT: 5px; MARGIN-LEFT: 5px; BORDER-LEFT: #1010ff 2px solid"> <META content="MSHTML 6.00.2900.2963" name=GENERATOR> <STYLE></STYLE> <DIV><FONT face=Arial size=2>Dear <FONT face="Times New Roman" size=3>Rahnama</FONT></FONT></DIV> <DIV>The number of valence electros is fixed in the case.in2 file.</DIV> <DIV>Are you talking about total number of electrons y valence band? or Are you trying to evaluate it in a specific band?</DIV> <DIV>Regards</DIV> <DIV>Ricardo</DIV> <DIV><FONT face=Arial size=2></FONT> </DIV> <DIV><FONT face=Arial size=2> </FONT></DIV> <DIV>-------------------------------------------------------------------------<BR>----- Ing. Quím. Ricardo Faccio<BR> <BR> Mail: Cryssmat-Lab.,
Cátedra de Física, DETEMA<BR> Facultad de Química, Universidad de la República<BR> Av. Gral. Flores 2124, C.C. 1157<BR> C.P. 11800, Montevideo, Uruguay.<BR> E-mail: <A href="mailto:rfaccio@fq.edu.uy">rfaccio@fq.edu.uy</A><BR> Phone: 598 2 9241860 Int. 109<BR> 598 2 9290705<BR> Fax: 598 2 9241906<BR> Web: <A href="http://cryssmat.fq.edu.uy/ricardo/ricardo.htm">http://cryssmat.fq.edu.uy/ricardo/ricardo.htm</A></DIV> <BLOCKQUOTE style="PADDING-RIGHT: 0px; PADDING-LEFT: 5px; MARGIN-LEFT: 5px; BORDER-LEFT: #000000 2px solid; MARGIN-RIGHT: 0px"> <DIV style="FONT: 10pt arial">----- Original Message ----- </DIV> <DIV style="BACKGROUND: #e4e4e4; FONT: 10pt arial; font-color: black"><B>From:</B> <A title=h_rahnamay@yahoo.com href="mailto:h_rahnamay@yahoo.com">hossien rahnama</A> </DIV>
<DIV style="FONT: 10pt arial"><B>To:</B> <A title=wien@zeus.theochem.tuwien.ac.at href="mailto:wien@zeus.theochem.tuwien.ac.at">wien@zeus.theochem.tuwien.ac.at</A> </DIV> <DIV style="FONT: 10pt arial"><B>Sent:</B> Monday, October 15, 2007 7:46 AM</DIV> <DIV style="FONT: 10pt arial"><B>Subject:</B> [Wien] number of electrons in valence band</DIV> <DIV><FONT face=Arial size=2></FONT><FONT face=Arial size=2></FONT><FONT face=Arial size=2></FONT><BR></DIV> <DIV class=MsoNormal dir=ltr style="MARGIN: 0in 0in 0pt"><FONT face="Times New Roman" size=3>Dear Wien2k users,</FONT></DIV> <DIV class=MsoNormal dir=ltr style="MARGIN: 0in 0in 0pt"><FONT face="Times New Roman" size=3>Thanks a lot for your attentions. I want to calculate, number of electrons in valence band for In<SUB>2</SUB>O<SUB>3</SUB> with 80 atoms in unit cell. How can I calculate, the number of electrons in valence band for In<SUB>2</SUB>O<SUB>3</SUB>?</FONT></DIV> <DIV class=MsoNormal dir=ltr style="MARGIN: 0in
0in 0pt"><FONT face="Times New Roman" size=3>Thank you for any suggestion in advanced.</FONT></DIV> <DIV class=MsoNormal dir=ltr style="MARGIN: 0in 0in 0pt"><FONT face="Times New Roman" size=3>Rahnama</FONT></DIV> <DIV class=MsoNormal dir=ltr style="MARGIN: 0in 0in 0pt"><?xml:namespace prefix = o ns = "urn:schemas-microsoft-com:office:office" /><o:p><FONT face="Times New Roman" size=3> </FONT></o:p></DIV><BR><BR>Hossein Asghar Rahnamaye Aliabad(PH.D Student)<BR>Electroceramic and Material Laboratory<BR>Department of Physics,Faculty of Science<BR>Ferdowsi University of Mashhad, Iran<BR>Phone: +98 511 8644047<BR>Web: www.um.ac.ir<BR>Email: ho_ra71@stu-mail.um.ac.ir, h_rahnamay@yahoo.com <div> <HR SIZE=1> Yahoo! oneSearch: Finally, <A href="http://us.rd.yahoo.com/evt=48252/*http://mobile.yahoo.com/mobileweb/onesearch?refer=1ONXIC">mobile search that gives answers</A>, not web links. <div> <HR> <div></div>_______________________________________________<BR>Wien
mailing list<BR>Wien@zeus.theochem.tuwien.ac.at<BR>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien<BR></BLOCKQUOTE>_______________________________________________<BR>Wien mailing list<BR>Wien@zeus.theochem.tuwien.ac.at<BR>http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien<BR></BLOCKQUOTE><BR><BR><BR>Hossein Asghar Rahnamaye Aliabad(PH.D Student)<br>Electroceramic and Material Laboratory<br>Department of Physics,Faculty of Science<br>Ferdowsi University of Mashhad, Iran<br>Phone: +98 511 8644047<br>Web: www.um.ac.ir<br>Email: ho_ra71@stu-mail.um.ac.ir, h_rahnamay@yahoo.com<p> 
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