<br><br><div class="gmail_quote">On Sun, Jul 29, 2012 at 6:17 PM, zafar rasheed <span dir="ltr"><<a href="mailto:zafartariq2003@yahoo.com" target="_blank">zafartariq2003@yahoo.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<table border="0" cellpadding="0" cellspacing="0"><tbody><tr><td style="font:inherit" valign="top">Dear All <br>
I am a bit confused about the type of pseudopotentials. <br></td></tr></tbody></table></blockquote><div> </div><blockquote class="gmail_quote" style="margin:0pt 0pt 0pt 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex">
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PW91 ===> LDA or GGA? >>>>> it is GGA..<br></td></tr></tbody></table></blockquote><div> </div><blockquote class="gmail_quote" style="margin:0pt 0pt 0pt 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex">
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PZ====> LDA ----is it right.....yes.<br></td></tr></tbody></table></blockquote><div> </div><blockquote class="gmail_quote" style="margin:0pt 0pt 0pt 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><table border="0" cellpadding="0" cellspacing="0">
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PBE ======> GGA?...yes<br></td></tr></tbody></table></blockquote><div> </div><blockquote class="gmail_quote" style="margin:0pt 0pt 0pt 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><table border="0" cellpadding="0" cellspacing="0">
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BLYP======> GGA? this is the another type of pseudopotentail whose property is similar to GGA means PBE.<br><br></td></tr></tbody></table></blockquote><div>Better search at pw forum, you will find losts of info regarding this. <br>
<br></div><blockquote class="gmail_quote" style="margin:0pt 0pt 0pt 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><table border="0" cellpadding="0" cellspacing="0"><tbody><tr><td style="font:inherit" valign="top">
Muhammad Zafar<br>
PhD Scholar<br>
Department of Physics<br>
The Islamia University of Bahawalpur,Pakistan</td></tr></tbody></table><br>_______________________________________________<br>
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<br></blockquote></div><br><br clear="all"><br>-- <br>Thanks and Regards<br>Bramha Prasad Pandey<br>Ph.D Student Indian School of Mines(ISM)<br>Dhanbad, INDIA.<br><br>