UCL-ARC / UCL-ARC/rcps-buildscripts
Install Request: Quantum Espresso 7.3 GPU and CPU variants
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@balston is already working on this.
Since Apr 16, 2024.
App install
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Myriad
Young
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- Shell
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Description
IN:06165073
Recently on the Quantum Espresso mailing list a group posted impressive performance with the GPU version of the software.
They used the exact same GPUs that are available on the Young Cluster. Would it be possible for you to compile the GPU enabled 7.2 version of the software and to make it available via module load?
Spack 0.20 has 7.1 with cuda variant available. (Might be a straightforward update to get it to build 7.2, might not).
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