<div dir="ltr"><div>Hello everyone, I'm new to CP2K and am trying to compile the code with CUDA support. In the toolchain script, I noticed th<code>e --gpu-ver argument help says:</code></div><div><code><br></code></div><div><code><div style="background-color: rgb(250, 250, 250); border-color: rgb(187, 187, 187); border-style: solid; border-width: 1px; overflow-wrap: break-word;" class="prettyprint"><code class="prettyprint"><div class="subprettyprint"><span style="color: #660;" class="styled-by-prettify">--</span><span style="color: #000;" class="styled-by-prettify">gpu</span><span style="color: #660;" class="styled-by-prettify">-</span><span style="color: #000;" class="styled-by-prettify">ver                 </span><span style="color: #606;" class="styled-by-prettify">Selects</span><span style="color: #000;" class="styled-by-prettify"> the GPU architecture </span><span style="color: #008;" class="styled-by-prettify">for</span><span style="color: #000;" class="styled-by-prettify"> which to compile</span><span style="color: #660;" class="styled-by-prettify">.</span><span style="color: #000;" class="styled-by-prettify"> </span><span style="color: #606;" class="styled-by-prettify">Available</span><span style="color: #000;" class="styled-by-prettify"><br>                          options are</span><span style="color: #660;" class="styled-by-prettify">:</span><span style="color: #000;" class="styled-by-prettify"> K20X</span><span style="color: #660;" class="styled-by-prettify">,</span><span style="color: #000;" class="styled-by-prettify"> K40</span><span style="color: #660;" class="styled-by-prettify">,</span><span style="color: #000;" class="styled-by-prettify"> K80</span><span style="color: #660;" class="styled-by-prettify">,</span><span style="color: #000;" class="styled-by-prettify"> P100</span><span style="color: #660;" class="styled-by-prettify">,</span><span style="color: #000;" class="styled-by-prettify"> V100</span><span style="color: #660;" class="styled-by-prettify">,</span><span style="color: #000;" class="styled-by-prettify"> </span><span style="color: #008;" class="styled-by-prettify">no</span><span style="color: #660;" class="styled-by-prettify">.</span><span style="color: #000;" class="styled-by-prettify"> </span><span style="color: #606;" class="styled-by-prettify">Default</span><span style="color: #660;" class="styled-by-prettify">:</span><span style="color: #000;" class="styled-by-prettify"> </span><span style="color: #008;" class="styled-by-prettify">no</span><span style="color: #660;" class="styled-by-prettify">.</span><span style="color: #000;" class="styled-by-prettify"><br>                          </span><span style="color: #606;" class="styled-by-prettify">The</span><span style="color: #000;" class="styled-by-prettify"> script will determine the correct corresponding value </span><span style="color: #008;" class="styled-by-prettify">for</span><span style="color: #000;" class="styled-by-prettify"><br>                          nvcc</span><span style="color: #080;" class="styled-by-prettify">'s '</span><span style="color: #660;" class="styled-by-prettify">-</span><span style="color: #000;" class="styled-by-prettify">arch</span><span style="color: #080;" class="styled-by-prettify">' flag.<br></span></div></code></div></code></div><div><br><code></code></div><div><code>However, I thought that any <a href="https://developer.nvidia.com/cuda-gpus">CUDA-enabled GPU</a> would be supported as long as it supports a sufficiently high compute API version. Can someone please clarify this for me, or point me to a list of supported GPU's in the docs? (Apologies if that exists somewhere; I have searched and not been able to find it.)</code></div><div><code><br></code></div><div><code>I am specifically interested in running cp2k on a GTX 960 and/or RTX 2060 and want to confirm that this in possible.<br></code></div><div><code><br></code></div><div><code>Thank you!<br></code></div></div>