Match comparison for Exchange energy (match type 30834)

Commits > Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 > Input 07-noncollinear.02-acbn0.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.982098414000000e+01 1.550000000000000e-06 -1.982098328156250e+01 1.179520848772420e-06 -1.982098274500000e+01 2.464999999673978e-06 FAIL

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Detailed information

Reference: -19.82098414, precision: 0.00000155
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.982098038000000e+01 3.759999998464991e-06 2.425806450622575e+00 FAIL
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.982098028000000e+01 3.859999999633601e-06 2.490322580408775e+00 FAIL
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.982098098000000e+01 3.159999998558760e-06 2.038709676489523e+00 FAIL
foss_cmake: [foss2022a-serial, foss-min] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
foss-serial-min: [foss2023b-serial] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
foss-serial-min: [foss2022a-serial] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
foss-serial-min: [foss2023a-serial] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
foss-serial-full: [foss2023a-serial] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
foss-opt-full: [foss2023a-serial] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
intel-serial: [intel2023a-serial] -1.982098386000000e+01 2.800000018510218e-07 1.806451624845302e-01 PASS
foss-serial-full: [foss2023b-serial] -1.982098490000000e+01 -7.599999989338357e-07 -4.903225799573134e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.982098072000000e+01 3.419999998754975e-06 2.206451612099984e+00 FAIL
foss-ppc: [foss2022a-serial] -1.982098363000000e+01 5.099999995650251e-07 3.290322577838871e-01 PASS
foss-serial-debug: [foss2023a-serial] -1.982098281000000e+01 1.329999999910569e-06 8.580645160713350e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
intel-omp: [intel2023a-serial] -1.982098368000000e+01 4.599999989807202e-07 2.967741928907872e-01 PASS
intel-omp: [intel2022a-serial] -1.982098521000000e+01 -1.069999999714355e-06 -6.903225804608742e-01 PASS
foss-omp-full: [foss2023a-serial] -1.982098406000000e+01 7.999999951380232e-08 5.161290291213053e-02 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
foss-mpi-full: [foss2023a-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.982098396000000e+01 1.800000006824121e-07 1.161290326983304e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.982098424000000e+01 -1.000000011686097e-07 -6.451612978619983e-02 PASS
foss-mpi-debug: [foss2023a-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
foss-mpi-min: [foss2023a-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
foss-mpi-min: [foss2022a-mpi] -1.982098384000000e+01 2.999999999531155e-07 1.935483870665262e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.982098390000000e+01 2.399999985414070e-07 1.548387087363916e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.982098422000000e+01 -7.999999951380232e-08 -5.161290291213053e-02 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -1.982098395000000e+01 1.900000015098158e-07 1.225806461353650e-01 PASS