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Merge pull request #1204 from edoapra/fix_pme_peigscomm

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QA tests update
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NWChem: Open Source High-Performance Computational Chemistry 2025-11-06 10:35:52 -08:00 • committed by GitHub
commit e9a9a153fa
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2 changed files with 31281 additions and 1 deletions
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QA/doqmtests.mpi
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@ -751,7 +751,7 @@ let "myexit+=$?"
let "myexit+=$?"
./runtests.mpi.unix procs $np H2COWat_VEMExc_CISHF
let "myexit+=$?"
./runtests.mpi.unix procs $np p2ta-vem
./runtests.mpi.unix procs $np p2ta-vem-ri
let "myexit+=$?"
./runtests.mpi.unix procs $np bsse_sodft
let "myexit+=$?"

31280
QA/tests/p2ta-vem-ri/p2ta-vem-ri.out Normal file
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