Custom HPC software & tools from Wirawan. Primarily tailored toward ODU HPC sytems.
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NWCHEM BUILD NOTES
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Date: 2021-04-14
Wirawan Purwanto
Tools & libraries used:
* gcc 7.3 (natively provided by Ubuntu 18.04)
* OpenMPI 3.1.4 (module: openmpi/3.1.4)
Build scripts derived from similar scripts from ODU's container repo.
ARMCI backend tried:
* ARMCI (armci-mpi): Still failed.
* OPENIB: Succeeded.