On 4/5/24 07:00, 胡大展 wrote:
But there is no gcc640 & openmpi-1.10.7 in my HPC:
You do not need that specific version of the compiler and of OpenMP.
The list you report is old and suitable for an old code version. If you
plan to use a recent version of the code, you may use any recent version
of GCC or Intel and OpenMPI. Same if you want to use the old code
version instead, but you should maybe avoid the most recent compiler
releases.
Paolo
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Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216
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