Match comparison for M-solvent int. energy @ t=21*dt (match type 12047)

Commits > Commit 69bdc22e524ab1df7701119670aff9b913714e90 > Input 32-tdpcm_methane.03-td_prop_eom.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.502587164251000e-02 1.000000000000000e-04 -1.508533060257886e-02 5.627424232960305e-14 -1.508533060252283e-02 1.570956906227217e-13 PASS

Checks for this match

  • GPU builders have different values.
  • Intel® builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -0.01502587164251, precision: 0.0001
Run Value Difference Relative difference Status
intel_mpi_omp_autotools: [intel2022a-mpi] -1.508533060236574e-02 -5.945895985574011e-05 -5.945895985574010e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -1.508533060267993e-02 -5.945896016993149e-05 -5.945896016993149e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.508533060265576e-02 -5.945896014576332e-05 -5.945896014576332e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.508533060260742e-02 -5.945896009742525e-05 -5.945896009742525e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.508533060265576e-02 -5.945896014576332e-05 -5.945896014576332e-01 PASS
foss_autotools: [foss2022a-serial] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -1.508533060260742e-02 -5.945896009742525e-05 -5.945896009742525e-01 PASS
foss_autotools: [foss2023b-serial] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS
foss_autotools: [foss2023a-serial] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.508533060263159e-02 -5.945896012159342e-05 -5.945896012159342e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
intel_autotools: [intel2023a-serial] -1.508533060246241e-02 -5.945895995241451e-05 -5.945895995241451e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
foss-serial-min: [foss2022a-serial] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
foss-serial-min: [foss2023b-serial] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -1.508533060263159e-02 -5.945896012159342e-05 -5.945896012159342e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
foss-serial-min: [foss2023a-serial] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS
foss-opt-full: [foss2023a-serial] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
intel_omp_autotools: [intel2022a-serial] -1.508533060253492e-02 -5.945896002491902e-05 -5.945896002491902e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.508533060253492e-02 -5.945896002491902e-05 -5.945896002491902e-01 PASS
foss-serial-debug: [foss2023a-serial] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.508533060263159e-02 -5.945896012159342e-05 -5.945896012159342e-01 PASS
foss-omp-full: [foss2023a-serial] -1.508533060258326e-02 -5.945896007325709e-05 -5.945896007325708e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.508533060263159e-02 -5.945896012159342e-05 -5.945896012159342e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.508533060253492e-02 -5.945896002491902e-05 -5.945896002491902e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.508533060260742e-02 -5.945896009742525e-05 -5.945896009742525e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.508533060260742e-02 -5.945896009742525e-05 -5.945896009742525e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -1.508533060255909e-02 -5.945896004908892e-05 -5.945896004908892e-01 PASS