Match comparison for Total energy (match type 30793)

Commits > Commit f72050fe95608e153e1887ef05d1ad42dc082fde > Input 07-noncollinear.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.208940827000000e+02 7.150000000000000e-08 -1.208940827618750e+02 3.146799057166111e-08 -1.208940827050000e+02 6.500000182541044e-08 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: -120.8940827, precision: 0.0000000715
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-serial-min: [foss2023a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-serial-min: [foss2022a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-serial-full: [foss2023b-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-serial-min: [foss2023b-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-opt-full: [foss2023a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-ppc: [foss2022a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-serial-full: [foss2023a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-serial-debug: [foss2023a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
intel_omp_autotools: [intel2022a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-omp-full: [foss2023a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-mpi-full: [foss2023a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
intel-serial: [intel2023a-serial] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-mpi-min: [foss2022a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-mpi-min: [foss2023a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.208940827700000e+02 -6.999999868639861e-08 -9.790209606489316e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.208940826400000e+02 6.000000496442226e-08 8.391609085933184e-01 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -1.208940826400000e+02 6.000000496442226e-08 8.391609085933184e-01 PASS