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<p class="MsoNormal"><span lang="EN-US">Hello,<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">I am trying to use the SCAN functional with QE 7.2 and libxc 5.2.3. I have found some older threads about what value to assign to input_dft, but all the following have failed so far:<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">“scan”<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">“r2scan”<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">“rvv10-scan”<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">“</span>XC-000i-000i-000i-000i-263L-292L<span lang="EN-US">“<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">“</span>XC-001i-004i-013i-vdw2<span lang="EN-US">”<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">The code stops and prints the error message:<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">“””<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">program stopped due to: functional name unknown<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">STOP must stop!<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">“””<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">Could you provide me any guidance on how to overcome this? Is this an issue with the libxc version?
<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US"><o:p> </o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">Kind regards,<o:p></o:p></span></p>
<p class="MsoNormal"><span lang="EN-US">Pedro Melo<o:p></o:p></span></p>
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