<div dir="ltr"><div dir="ltr">On Fri, Jul 3, 2020 at 1:36 AM Shen, Ziheng <<a href="mailto:zshen83@gatech.edu">zshen83@gatech.edu</a>> wrote:</div><div dir="ltr"><br></div><div class="gmail_quote"><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex">
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<div class="gmail-m_-8305290934487726176WordSection1"><span style="font-size:11pt;font-family:"Calibri",sans-serif;color:windowtext">I’m wondering is spin-polarized calculation only available for standard functionals such as PBE?</span></div></div></blockquote><div><br></div><div>spin-polarized calculations are available for many functionals, but not all. The less "standard" a functional is, the harder and less likely a spin-polarized implementation is.</div><div><br></div><div>Paolo<br clear="all"></div></div>-- <br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div>Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,<br>Univ. Udine, via delle Scienze 208, 33100 Udine, Italy<br>Phone +39-0432-558216, fax +39-0432-558222<br><br></div></div></div></div></div></div>