<div dir="ltr"><div>I am having problems in the post processing of bandstructures. This problem was raised in a forum thread, and from the post (<a href="https://quantumwise.com/forum/index.php?topic=4824.msg21876#msg21876">https://quantumwise.com/forum/index.php?topic=4824.msg21876#msg21876</a>), it said:</div><br>"<span style="color:rgb(0,0,0);font-family:"exo 2",verdana,arial,helvetica,sans-serif;font-size:14.4px;background-color:rgb(240,244,247)">Yes there is a bug due to a difference between how QE and VNL interprets numerically the values of the k-points: VNL identifies automatically the K-point with a precision of 10-8, but QE prints out the k-points in the band structure only with 4 decimals. Hence, the K-point is not identified as an high symmetry point and it is not printed out. "</span><div><font color="#000000" face="exo 2, verdana, arial, helvetica, sans-serif"><span style="font-size:14.4px"><br></span></font></div><div><font color="#000000" face="exo 2, verdana, arial, helvetica, sans-serif"><span style="font-size:14.4px">Is it possible to manually change the precision of QE output to 10-8? Thanks.<br clear="all"></span></font><div><br></div>-- <br><div class="gmail_signature"><div dir="ltr"><font size="1">Engr. Wilbert James C. Futalan<br>Research Fellow I<br>Laboratory of Electrochemical Engineering</font><div><font size="1">Department of Chemical Engineering</font></div><div><font size="1">University of the Philippines - Diliman</font></div></div></div>
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