[CP2K-user] Could I specify how many GPUs I want in CP2K?

jt Yang jtyan... at gmail.com
Tue Dec 10 13:10:48 UTC 2019


Hi,everyone

I've compiled newest cp2k(7.0 development) in my serve, unfortunately for 
some reason, I can't specify the gpu numbers I want with PBS.

Could I specify how many GPUs I want in CP2K? like set "nthreads=2" in 
config file?

Thanks for any advice.

J.T.Yang
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20191210/6ab06c04/attachment.htm>


More information about the CP2K-user mailing list