<br><br><div class="gmail_quote">On Fri, Jul 6, 2012 at 4:01 AM, Gavin Abo <span dir="ltr"><<a href="mailto:gsabo@crimson.ua.edu" target="_blank">gsabo@crimson.ua.edu</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div bgcolor="#FFFFFF" text="#000000">
<div>Check into whether BoltzTraP (a
separate code from Wien2k) can do what you want, there is a link
to the code on the unsupported page:<br>
<br>
<a href="http://www.wien2k.at/reg_user/unsupported/" target="_blank">http://www.wien2k.at/reg_user/unsupported/</a><br>
<br>
Also, refer to:<br>
<br>
<a href="http://zeus.theochem.tuwien.ac.at/pipermail/wien/2012-February/016178.html" target="_blank">http://zeus.theochem.tuwien.ac.at/pipermail/wien/2012-February/016178.html</a><div><div class="h5"><br>
<br>
On 7/5/2012 10:19 AM, Alex Animalu wrote:<br>
</div></div></div>
<blockquote type="cite"><div><div class="h5">
<table border="0" cellpadding="0" cellspacing="0">
<tbody>
<tr>
<td style="font:inherit" valign="top">Dear Wien2k Users,<br>
Pls, I am new to wien2k. I have successfully done a
converged self-consistent calculation for ZrO2. Now, I
need the carrier density (concentration) of the system. I
know that lapw5 calculates <span>charge density</span> and other
information are in *.scf. Please, help me by guiding me to
where I can find the carrier density (in unit of say 10^18
per cm cube) in my output or how to obtain it. <br>
<br>
Thank you very much for your help.</td>
</tr>
</tbody>
</table>
<br>
<fieldset></fieldset>
<br>
</div></div><pre>_______________________________________________
Wien mailing list
<a href="mailto:Wien@zeus.theochem.tuwien.ac.at" target="_blank">Wien@zeus.theochem.tuwien.ac.at</a>
<a href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien" target="_blank">http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</a>
</pre>
</blockquote>
<br>
<br>
</div>
<br>_______________________________________________<br>
Wien mailing list<br>
<a href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a><br>
<a href="http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien" target="_blank">http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien</a><br>
<br></blockquote></div><br><br clear="all"><br>-- <br>***********************************************<br>Dr. Avijit Ghosh<br>Assistant Professor<br>Centre for Applied Physics<br>Central University of Jharkhand,<br>Ratu- Lohardaga Road,<br>
Brambe, Ranchi<br>Jharkhand-835205<br>INDIA.<br>Mob: +919474403587<br>E-mail: <a href="mailto:avijit@phy.iitkgp.ernet.in" target="_blank">avijit@phy.iitkgp.ernet.in</a><br> <a href="mailto:avi_phy@rediffmail.com" target="_blank">avi_phy@rediffmail.com</a><br>