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Segfault for large DF-MP3 calculation #1764

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Segfault for large DF-MP3 calculation#1764
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coding-neededFor issues where we know the issue and need somebody to code the solution.crashFor issues that cause a Psi4 non-compile, crash, segfault, or algorithm failure.dfoccFor issues in the DFOCC module.
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@devinamatthews
devinamatthews
opened on Dec 2, 2019

A DF-MP3 calculation of C36H38/cc-pVDZ (36ene) fails with a segfault in the OCC module. See attached output file.
output.txt

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    coding-neededFor issues where we know the issue and need somebody to code the solution.crashFor issues that cause a Psi4 non-compile, crash, segfault, or algorithm failure.dfoccFor issues in the DFOCC module.

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