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partial bugfix (kokkos_omp test passes, fix_modify test virial yes still crashes)

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alphataubio
2024-08-02 11:59:57 -04:00
parent 24fc761396
commit 2ef1e9936f
5 changed files with 220 additions and 29 deletions
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unittest/force-styles/tests/fix-timestep-wall_lj93_const.yaml
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@ -11,7 +11,7 @@ pre_commands: ! |
post_commands: ! |
fix move all nve
fix test solute wall/lj93 ylo EDGE 100.0 2.0 5.0 yhi EDGE 100.0 2.0 5.0
fix_modify test virial yes
# fix_modify test virial yes
input_file: in.fourmol
natoms: 29
run_stress: ! |2-