[CP2K-user] [CP2K:20221] How to obtain the graph file in ssmp version?

Krack Matthias matthias.krack at psi.ch
Tue May 21 08:00:11 UTC 2024


Dear Fangling Yang

you can try to download the statically linked graph binary from the CP2K release 2024.1 via this link<https://www.cp2k.org/static/downloads/graph-2024.1-Linux-gnu-x86_64.ssmp>.

Best

Matthias

From: cp2k at googlegroups.com <cp2k at googlegroups.com> on behalf of Fangling Yang <yangfl23scu at gmail.com>
Date: Monday, 20 May 2024 at 15:16
To: cp2k <cp2k at googlegroups.com>
Subject: [CP2K:20220] How to obtain the graph file in ssmp version?
Dear cp2k developers and users,

I download the precompiled version cp2k.ssmp (V.2024.1) from Git Hub. The program can run normally on my Linux computer.
However,  I can not find the graph file in my installation directory when dealing with the result of metadynamics.
It seems the issue stems from a lack of compilation. Can I obtain this file from a different strategy (like downloading from a website) to bypass the compiling process?
I would be grateful if you could give me a comment or suggestion.

Best regards,
Fangling Yang
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