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Omp bug fix#273

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ilfreddy merged 4 commits intoMRChemSoft:masterfrom
gitpeterwind:ompbugfix
Jan 6, 2026
Merged

Omp bug fix#273
ilfreddy merged 4 commits intoMRChemSoft:masterfrom
gitpeterwind:ompbugfix

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@gitpeterwind
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In the serial case (one mpi process or compiled without mpi), there was a possibility for race condition, i.e. code could not give right answer in random cases. This bug has been present for long time and therefore did probably not have consequences in general cases.

@ilfreddy ilfreddy merged commit 14ebd2d into MRChemSoft:master Jan 6, 2026
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2 participants