<div dir="ltr">Hi,<br>Actually, you should align with fermi level yourself when preparing DOS plot. <br><br>Regards<br><br><br><div class="gmail_quote">On Thu, Oct 16, 2008 at 12:02 PM, <span dir="ltr"><<a href="mailto:ski2@mail.uh.edu">ski2@mail.uh.edu</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;">Dear All, <br><br>I have two simple questions about Fermi level and DOS.<br>For insulator electronic structure calculations, is the Fermi level evaluated set to the top of a valence band? <br>
When DOS plotted, is the Fermi level manually set to zero by shifting the value achieved self consistently in a scf.out file?<br><br>Best Wishes,<br>Sang-Hwan<br><br><br>Department of Chemistry<br>University of Houston<br>
136 Fleming Building<br>Houston, TX 77204-5003
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<br></blockquote></div><br><br clear="all"><br>-- <br>Hai-Ping Lan <br>Department of Electronics ,<br>Peking University , Bejing, 100871<br><a href="mailto:lanhaiping@gmail.com">lanhaiping@gmail.com</a>, <a href="mailto:hplan@pku.edu.cn">hplan@pku.edu.cn</a><br>
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