<div dir="auto"><div dir="auto">Dear Fatemeh khalili<div dir="auto">For printing spin density and electron density cube files you have to use &PRINT subsection in CP2k input file structure like <a href="https://manual.cp2k.org/trunk/CP2K_INPUT.html" style="">CP2K_INPUT</a> / <a href="https://manual.cp2k.org/trunk/CP2K_INPUT/FORCE_EVAL.html" style="">FORCE_EVAL</a> / <a href="https://manual.cp2k.org/trunk/CP2K_INPUT/FORCE_EVAL/DFT.html" style="">DFT</a> /<a href="https://manual.cp2k.org/trunk/CP2K_INPUT/FORCE_EVAL/DFT/PRINT.html" style="">PRINT</a> / <a href="https://manual.cp2k.org/trunk/CP2K_INPUT/FORCE_EVAL/DFT/PRINT/MO.html" style="">MO</a> to print cube files. Does this answer your question? </div><div dir="auto">Or did you mean something else? </div></div><br><div class="gmail_quote"><div dir="ltr">On Wed, 19 Dec 2018, 01:09 Fatemeh Khalili <<a href="mailto:fsh.k...@gmail.com" target="_blank" rel="noreferrer">fsh.k...@gmail.com</a> wrote:<br></div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr"><div dir="ltr">Dear all,<div>would you plz advice me about density cube file integration?</div><div>I find some related code but it dosen't work for me!</div><div><a href="https://github.com/funkymunkycool/Cube-Toolz" rel="noreferrer noreferrer" target="_blank">https://github.com/funkymunkycool/Cube-Toolz</a><br clear="all"><div><br></div>-- <br><div dir="ltr" class="m_4189193525130011154m_-1873640011489941102gmail_signature"><div dir="ltr">Best Regards,<br>Fatemeh Khalili<br>PhD candidate <br>Department of Physics <br>Shahid Beheshti University</div></div></div></div></div>

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