<div dir="ltr">Dear Mahmoud,<div><br></div><div> Use this command:</div><div><br></div><div> K_POINT (automatic)</div><div> nk1 nk2 nk3 sk1 sk2 sk3</div><div><br></div><div> From pw.x manual: </div><div><span style="color:rgb(0,0,0);font-size:14px"> <br></span></div><dt style="color:rgb(0,0,0)"><tt style=""><font face="arial, sans-serif"><span class="gmail-flag" style="color:rgb(0,128,0);font-weight:bold">automatic</span> :</font></tt></dt><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif">automatically generated uniform grid of k-points, i.e,
generates ( nk1, nk2, nk3 ) grid with ( sk1, sk2, sk3 ) offset.</font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif"><br></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif"><br></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif"><br></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif"><br></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif"><br></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif">For further details see: <a href="https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1487" style="">https://www.quantum-espresso.org/Doc/INPUT_PW.html#idm1487</a></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><br></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><br></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif"><br></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif"><br></font></pre></dd><dd style="color:rgb(0,0,0)"><pre style="margin-top:0em"><font face="arial, sans-serif">Best regards,</font></pre></dd></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">Em qua., 14 de dez. de 2022 às 13:43, Mahmoud Payami Shabestari via users <<a href="mailto:users@lists.quantum-espresso.org">users@lists.quantum-espresso.org</a>> escreveu:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div>
<div style="font-size:16px;font-family:Tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal;background:none 0% 0% repeat scroll rgba(0,0,0,0)">Hi All.</div>
<div style="font-size:16px;font-family:Tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal;background:none 0% 0% repeat scroll rgba(0,0,0,0)">I wonder if there is an option to specify the k-point mesh in BZ in the form of uniform k-point density.</div>
<div style="font-size:16px;font-family:Tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal;background:none 0% 0% repeat scroll rgba(0,0,0,0)">Any comments is highly appreciated.</div>
<div style="font-size:16px;font-family:Tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal;background:none 0% 0% repeat scroll rgba(0,0,0,0)"> </div>
<div style="font-size:16px;font-family:Tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal;background:none 0% 0% repeat scroll rgba(0,0,0,0)">Bests,</div>
<div style="font-size:16px;font-family:Tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal;background:none 0% 0% repeat scroll rgba(0,0,0,0)"> </div>
<div id="m_-1530243928321933061signature" style="font-size:16px;font-family:Tahoma;color:rgb(0,0,0);font-weight:400;font-style:normal;background:none 0% 0% repeat scroll rgba(0,0,0,0)">
<div style="font-family:Tahoma;color:rgb(0,0,0);font-size:16px;font-weight:400;font-style:normal">Mahmoud Payami</div>
<div style="font-family:Tahoma;color:rgb(0,0,0);font-size:16px;font-weight:400;font-style:normal">NSTRI, AEOI, Tehran, Iran</div>
<div style="font-family:Tahoma;color:rgb(0,0,0);font-size:16px;font-weight:400;font-style:normal">Email: <a href="mailto:mpayami@aeoi.org.ir" target="_blank">mpayami@aeoi.org.ir</a></div>
<div style="font-family:Tahoma;color:rgb(0,0,0);font-size:16px;font-weight:400;font-style:normal">Phone: +98 (0)21 82066504</div>
<div style="font-family:Tahoma;color:rgb(0,0,0);font-size:16px;font-weight:400;font-style:normal">--------------------------------------------------------</div>
<div style="font-family:Tahoma;color:rgb(0,0,0);font-size:16px;font-weight:400;font-style:normal"> </div>
</div>
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