<div dir="ltr"><div><div><div><div><div><div>Hello,</div><div><br></div><div>[Its with Wien2k_17.1]</div><div><br></div>I am running TM doped PbS with -sp.</div><div><br></div>I am not able to get any number (band gap ) from grepĀ :GAP command (grep :GAPĀ *.scf) while :FER or any other switches are working well.<br></div><br></div><br><br></div>It is known to me that whether a material is metallic or semiconductor, "grep :GAP *.scf" should always work.<br><br></div>What is the possible issue of not getting GAP value (0.0 eV or x.y eV, ...) in the present case?<br clear="all"><div><div><div><div><div><div><div><div><div><div class="gmail_signature" data-smartmail="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><span style="font-size:12.8px"><br></span></div><div dir="ltr"><span style="font-size:12.8px"><br></span></div>Regards</div><div>K.C. Bhamu<br></div></div></div></div></div></div></div></div>
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