regenerated unit tests with run_torque

2024-08-04 23:15:33 -04:00
parent 90cdb023dd
commit b83521b22e
8 changed files with 356 additions and 139 deletions
--- a/unittest/force-styles/test_fix_timestep.cpp
+++ b/unittest/force-styles/test_fix_timestep.cpp
@ -882,7 +882,7 @@ TEST(FixTimestep, kokkos_omp)
    ASSERT_EQ(lmp->atom->natoms, nlocal);

    // relax error a bit for KOKKOS package
-    double epsilon = 5.0 * test_config.epsilon;
+    double epsilon = 10.0 * test_config.epsilon;
    // relax test precision when using pppm and single precision FFTs
 #if defined(FFT_SINGLE)
    if (lmp->force->kspace && utils::strmatch(lmp->force->kspace_style, "^pppm")) epsilon *= 2.0e8;