Match comparison for Stress (13) (match type 29823)

Commits > Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 > Input 22-vdw_d3_stress.01-Be_hpc.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.739424690000000e-19 2.200000000000000e-18 -2.031670203312500e-18 1.404674750647250e-18 -1.286739098200000e-18 1.810107340800000e-18 FAIL

Checks for this match

  • Precision seems large and value close to zero. Should value be 0?
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -0.000000000000000000373942469, precision: 0.0000000000000000022
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
cmake_foss_2022a_full_mpi -3.015799179000000e-18 -2.641856710000000e-18 -1.200843959090909e+00 FAIL
cmake_foss_2022a_min_serial -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
cmake_foss_2022a_min_mpi -3.015799179000000e-18 -2.641856710000000e-18 -1.200843959090909e+00 FAIL
spack_foss-2022a_serial_min -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
spack_foss-2022a_serial -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
spack_foss-2022a_mpi_min -3.015799179000000e-18 -2.641856710000000e-18 -1.200843959090909e+00 FAIL
spack_foss-2022a_mpi -3.015799179000000e-18 -2.641856710000000e-18 -1.200843959090909e+00 FAIL
spack_foss-2023a_mpi_min -3.015799179000000e-18 -2.641856710000000e-18 -1.200843959090909e+00 FAIL
spack_foss-2023a_mpi -3.015799179000000e-18 -2.641856710000000e-18 -1.200843959090909e+00 FAIL
spack_foss-2023a_serial -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
spack_foss-2023a_mpi_opt -3.015799179000000e-18 -2.641856710000000e-18 -1.200843959090909e+00 FAIL
spack_foss-2023a_serial_min -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
spack_foss-2023a_serial_opt -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
spack_foss-2023a_serial_omp -2.694598945000000e-19 1.044825745000000e-19 4.749207931818183e-02 PASS
spack_foss-2023a_mpi_omp -1.842877135000000e-18 -1.468934666000000e-18 -6.676975754545456e-01 PASS
spack_foss-2023b_serial -3.096846439000000e-18 -2.722903970000000e-18 -1.237683622727273e+00 FAIL
spack_intel-2022a_serial_omp -5.447634778000000e-19 -1.708210088000000e-19 -7.764591309090911e-02 PASS
spack_intel-2023a_serial -1.282861645000000e-18 -9.089191760000000e-19 -4.131450800000000e-01 PASS
spack_intel-2023a_serial_omp 3.895801331000000e-19 7.635226021000000e-19 3.470557282272727e-01 PASS
spack_intel-2023a_impi 1.944738514000000e-19 5.684163204000000e-19 2.583710547272727e-01 PASS
spack_foss-2022a_cuda_mpi_omp 5.233682426000000e-19 8.973107116000001e-19 4.078685052727273e-01 PASS
spack_foss-2022a_cuda_serial -2.989392825000000e-19 7.500318650000004e-20 3.409235750000002e-02 PASS
spack_intel-2022a_impi_omp 2.567600932000000e-19 6.307025622000001e-19 2.866829828181819e-01 PASS