Match comparison for Hartree energy (match type 17189)

Commits > Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 > Input 10-helium_upf.02-gs_filter_ts.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.025381360000000e+00 1.010000000000000e-07 2.025381362121212e+00 1.199938780515330e-08 2.025381395000000e+00 3.500000000933312e-08 PASS

Checks for this match

  • MPI builders have different values.
  • OpenMP 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: 2.02538136, precision: 0.000000101
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2022a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-min] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023b-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-full] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_autotools: [intel2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-opt-full: [foss2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023b-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-ppc: [foss2022a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-debug: [foss2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2022a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-opt-full: [foss2023a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-omp-full: [foss2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-full: [foss2023a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-debug: [foss2023a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2023a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2022a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-omp-full: [foss2023a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
cuda-serial: [foss2022a-cuda-mpi] 2.025381430000000e+00 7.000000001866624e-08 6.930693071155073e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
valgrind: [foss2023a-serial] 2.025381360000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS