<div dir="ltr"><div>Dear Prof. Krack,</div><div><br></div><div>Thank you for your answer! I have currently working with SCCS and found mentioned article waiting for a calculation to end.</div><div>Taking the opportunity, I'd like to ask, do you plan to implement stress tensor into the SCCS model? It would make my (and I guess not only my) work way easier.</div><div><br></div><div>With thanks,</div><div>Anton K.<br></div><br>понедельник, 3 декабря 2018 г., 22:42:08 UTC+3 пользователь Matthias Krack написал:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;">





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<p class="MsoNormal"><span>Dear Anton</span></p>
<p class="MsoNormal"><span> </span></p>
<p class="MsoNormal"><span lang="EN-GB">it is not missing. The model is implemented, but the name of the input section is SCCS and not PCSM. Please check
<a href="https://manual.cp2k.org/cp2k-6_1-branch/CP2K_INPUT/FORCE_EVAL/DFT/SCCS.html" target="_blank" rel="nofollow" onmousedown="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fmanual.cp2k.org%2Fcp2k-6_1-branch%2FCP2K_INPUT%2FFORCE_EVAL%2FDFT%2FSCCS.html\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNHnmqdYecDUSzRWIGLEVGqecqDowQ';return true;" onclick="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fmanual.cp2k.org%2Fcp2k-6_1-branch%2FCP2K_INPUT%2FFORCE_EVAL%2FDFT%2FSCCS.html\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNHnmqdYecDUSzRWIGLEVGqecqDowQ';return true;">
https://manual.cp2k.org/cp2k-<wbr>6_1-branch/CP2K_INPUT/FORCE_<wbr>EVAL/DFT/SCCS.html</a> for details.</span></p>
<p class="MsoNormal"><span lang="EN-GB"> </span></p>
<p class="MsoNormal"><span lang="EN-GB">HTH</span></p>
<p class="MsoNormal"><span lang="EN-GB"> </span></p>
<p class="MsoNormal"><span lang="EN-GB">Matthias</span></p>
<p class="MsoNormal"><span lang="EN-GB"> </span></p>
<p class="MsoNormal"><b><span lang="DE">Von:</span></b><span lang="DE"> <a href="javascript:" target="_blank" gdf-obfuscated-mailto="KbnoGYRjBAAJ" rel="nofollow" onmousedown="this.href='javascript:';return true;" onclick="this.href='javascript:';return true;">cp...@googlegroups.com</a> <<a href="javascript:" target="_blank" gdf-obfuscated-mailto="KbnoGYRjBAAJ" rel="nofollow" onmousedown="this.href='javascript:';return true;" onclick="this.href='javascript:';return true;">cp...@googlegroups.com</a>>
<b>Im Auftrag von </b>Anton Kudelin<br>
<b>Gesendet:</b> Montag, 3. Dezember 2018 20:02<br>
<b>An:</b> cp2k <<a href="javascript:" target="_blank" gdf-obfuscated-mailto="KbnoGYRjBAAJ" rel="nofollow" onmousedown="this.href='javascript:';return true;" onclick="this.href='javascript:';return true;">cp...@googlegroups.com</a>><br>
<b>Betreff:</b> [CP2K:11001] Concerning PCSM</span></p>
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<p class="MsoNormal">Hi all,</p>
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<p class="MsoNormal">I found an useful <a href="https://doi.org/10.1016/j.pnsc.2017.03.003" target="_blank" rel="nofollow" onmousedown="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fdoi.org%2F10.1016%2Fj.pnsc.2017.03.003\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNHb8-eV2dcvoqPDdKK6h2Xeyn8jyw';return true;" onclick="this.href='https://www.google.com/url?q\x3dhttps%3A%2F%2Fdoi.org%2F10.1016%2Fj.pnsc.2017.03.003\x26sa\x3dD\x26sntz\x3d1\x26usg\x3dAFQjCNHb8-eV2dcvoqPDdKK6h2Xeyn8jyw';return true;">
article</a> referred to as "Periodic continuum solvation model integrated with first-principles calculations for solid surfaces" where authors described the implementation of the PCSM model in CP2K. Unfortunately, the corresponding feature in the official release
 is missed. Does anyone know the fate of this code?</p>
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<p class="MsoNormal">Best regards,</p>
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<p class="MsoNormal">Anton K.</p>
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