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attempt fix lammps test by removing seemingly unnecessary computes
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anjohan committed Jun 10, 2024
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1 change: 0 additions & 1 deletion tests/test_lammps.py
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Expand Up @@ -261,7 +261,6 @@ def test_lmp_calc():
param_dict = {
"pair_style": "lj/cut 2.5",
"pair_coeff": ["* * 1 1"],
"compute": ["1 all pair/local dist", "2 all reduce max c_1"],
"velocity": ["all create 300 12345 dist gaussian rot yes mom yes"],
"fix": ["1 all nvt temp 300 300 $(100.0*dt)"],
"dump_period": 1,
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