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electronic-structure / SIRIUS

Domain specific library for electronic structure calculations
BSD 3-Clause "New" or "Revised" License
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The test test_wf_ortho_1 doesn't finish after 67 minutes on 8 CPUs #866

Closed yurivict closed 1 year ago

yurivict commented 1 year ago 
  PID USERNAME    THR PRI NICE   SIZE    RES STATE    C   TIME    WCPU COMMAND
35494 yuri          8  84    0  1529M    74M RUN      0  68:21 282.94% test_wf_ortho_1

Version: 7.4.3 clang-15 mpich-3.4.3 FreeBSD 13.2

yurivict commented 1 year ago

Nope, it fin fished in 903.29 secs.