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<div dir="ltr" data-setdir="false">Dear Mr. <span>Pompermaier:</span></div><div dir="ltr" data-setdir="false"><span><br></span></div><div dir="ltr" data-setdir="false"><br></div><div dir="ltr" data-setdir="false">Try to use <span>absolute path instead of relative path?</span></div><div dir="ltr" data-setdir="false"><span><br></span></div><div dir="ltr" data-setdir="false"><span>Best Regards,</span></div><div dir="ltr" data-setdir="false"><span><br></span></div><div dir="ltr" data-setdir="false"><span>HY Lu</span></div><div dir="ltr" data-setdir="false"><span><br></span></div>
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在 2023年10月16日 星期一 下午09:24:15 [GMT+8]， Luiz Felipe<luizpompermaier@hotmail.com> 寫道：
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Dear qe community,</div>
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Recently, after much trouble, I managed to install qe 7.2 on Debian 11.7 OS.</div>
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I have already run the standard tests on the test-suite and except for a few epw modules, all passed.</div>
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Now I'm running another test on the pw.x module trying to get some known values for Si crystal¹.</div>
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The problem I'm facing, both with mpi and without, is that the pw.x module cannot find the pseudopotential file, although it is rightly indexed in the respective folder.</div>
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What can I do to fix this mistake?</div>
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I have also annexed the .in and .out files, and a print screen of the command terminal and the pseudopotential folder.</div>
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¹ The tutorial I am following for Si calculations is the one presented by Quantum Nerd on the video <a href="https://www.youtube.com/watch?v=v1LcTLSIkZI" id="ydp5c9590ebyiv0873561820LPlnkOWALinkPreview" target="_blank" rel="noreferrer noopener">https://www.youtube.com/watch?v=v1LcTLSIkZI</a></div>
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<a id="ydp5c9590ebyiv0873561820LPImageAnchor968834" href="https://www.youtube.com/watch?v=v1LcTLSIkZI" target="_blank" rel="noreferrer noopener"><img id="ydp5c9590ebyiv0873561820LPThumbnailImageId968834" alt="" style="display: block; width: 240px; max-width: 300px;" src="https://www.bing.com/th?id=OVP.NNc7iT_va7E2Q4Hity1Q9QEsDh&pid=Api"></a></div>
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<div id="ydp5c9590ebyiv0873561820LPTitle968834" style="font-size:21px;font-weight:300;margin-right:8px;font-family:UI WP Tahoma, Arial, sans-serif;margin-bottom:12px;">
<a id="ydp5c9590ebyiv0873561820LPUrlAnchor968834" href="https://www.youtube.com/watch?v=v1LcTLSIkZI" style="text-decoration:none;" target="_blank" rel="noreferrer noopener">Project: 3.1 Si crystal constant and density | Quantum Espresso Tutorial 2019</a></div>
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You can find the input file and reference output file in: https://github.com/quantumNerd/Quantum-Espresso-Tutorial-2019-Projects</div>
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www.youtube.com</div>
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Thankfully</div>
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Luiz Felipe Pompermaier</div>
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