Match comparison for Total energy 1 (match type 32208)

Commits > Commit 6873b983d1904fe0612bd483f61737dd2d8ed971 > Input 21-electronic_gs.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.060379681000000e+01 5.280000000000000e-04 -1.060376773242424e+01 1.144785302363849e-04 -1.060355692000000e+01 2.398900000004645e-04 PASS

Checks for this match

  • MPI builders have different values.
  • GPU builders have different values.
  • Intel® builders have different values.
    Zen 4 builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -10.60379681, precision: 0.000528
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_autotools: [intel2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2022a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023b-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023b-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-opt-full: [foss2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-omp-full: [foss2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-debug: [foss2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-ppc: [foss2022a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2022a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-full: [foss2023a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-debug: [foss2023a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2022a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2023a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -1.060331703000000e+01 4.797800000009289e-04 9.086742424260017e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.060331703000000e+01 4.797800000009289e-04 9.086742424260017e-01 PASS
valgrind: [foss2023a-serial] -1.060379681000000e+01 0.000000000000000e+00 0.000000000000000e+00 PASS