Dear Fang !<div>                      Browse the link below.<br><a href="http://www.democritos.it/pipermail/pw_forum/2010-May/016847.html">http://www.democritos.it/pipermail/pw_forum/2010-May/016847.html</a><br><br><div class="gmail_quote">
2010/6/8 Weyl Fang <span dir="ltr"><<a href="mailto:fwshuchao111@gmail.com" target="_blank">fwshuchao111@gmail.com</a>></span><br>
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<div><font size="2" face="Verdana">Dear all,</font></div>
<div><font size="2" face="Verdana"></font> </div>
<div><font size="2" face="Verdana">I am working on TiO2 with the QE-4.1.2. I am 
a beginner to use QE. Recently I want to know the charge of the individual 
atom in the system. Can I get the charge value like mulliken charge? 
</font><font size="2" face="Verdana">If I can, How can i get the value?</font></div>
<div><font size="2" face="Verdana"></font> </div>
<div><font size="2" face="Verdana">Any suggestion would be helpful. 
Thanks!</font></div>
<div><font size="2" face="Verdana"></font> </div>
<div><font size="2" face="Verdana">With regards</font></div>
<div><font size="2"></font> </div><font color="#888888">
<div><font size="2" face="Verdana">Weyl FANG<br>Graduate student in Chemical 
Engineering<br>State Key Laboratory of Materials-oriented Chemical 
Engineering<br>College of Chemistry and Chemical Engineering<br>Nanjing 
University of Technology, 210009, Nanjing, Jiangsu, China<br></font><font size="2" face="Verdana">Email: </font><a href="mailto:weylfang@gmail.com" target="_blank"><font size="2" face="Verdana">weylfang@gmail.com</font></a><font size="2" face="Verdana"> <br>

Office: 
Room A705, Technical Innovation Building, Xinmofan Road 5#, Nanjing, Jiangsu, 
China  </font></div>
<p></p></font></div>
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<br></blockquote></div><br><br clear="all"><br>-- <br>Regards,<br>MOHNISH,<br>-----------------------------------------------------------------<br>Mohnish Pandey<br>Y6927262,4th Year dual degree student,<br>Department of Chemical Engineering,<br>

IIT KANPUR, UP, INDIA<br>+919235721300<br>-----------------------------------------------------------------<br>
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