Hi,<br>Someone has answered your question yesterday.<br><br><div class="gmail_quote">On Wed, Sep 2, 2009 at 4:59 PM, Padmaja Patnaik <span dir="ltr"><<a href="mailto:padmaja_patnaik@yahoo.co.uk" target="_blank">padmaja_patnaik@yahoo.co.uk</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="border-left: 1px solid rgb(204, 204, 204); margin: 0pt 0pt 0pt 0.8ex; padding-left: 1ex;"><table border="0" cellpadding="0" cellspacing="0"><tbody><tr><td style="font-family: inherit; font-style: inherit; font-variant: inherit; font-weight: inherit; font-size: inherit; line-height: inherit; font-size-adjust: inherit; font-stretch: inherit;" valign="top">
Dear all,<br> Can anybody tell me how to know whether a state is fully
or partially filled from the calculations using PWSCF. Also, how to
know what is the number of occupancy in a state and the spin of the
electrons in a particular state.<br><br>Thanks in advance,<br>regards<br><br>Padmaja Patnaik<br>
Research Scholar<br>
Dept of Physics<br>
IIT Bombay<br>
Mumbai, India</td></tr></tbody></table><br>
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<br></blockquote></div><br><br clear="all"><br>-- <br>--------------------------------------------------<br>Duy Le<br>PhD Student<br>Department of Physics<br>University of Central Florida.<br>