Match comparison for Hartree energy (match type 30796)

Commits > Commit 70b0ad3565a7ed52254e6fb5a8a40b027abeb4a7 > Input 07-noncollinear.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.645947641000000e+01 2.160000000000000e-06 1.645947717705882e+01 1.752230411995151e-07 1.645947696500000e+01 3.849999998806197e-07 PASS

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Detailed information

Reference: 16.45947641, precision: 0.00000216
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 1.645947722000000e+01 8.099999995181406e-07 3.749999997769169e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 1.645947715000000e+01 7.400000008317420e-07 3.425925929776583e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 1.645947708000000e+01 6.699999985926297e-07 3.101851845336249e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 1.645947719000000e+01 7.800000005886432e-07 3.611111113836311e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_min_autotools: [foss2022a-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_min_autotools: [foss2023a-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_min_autotools: [foss2023b-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_autotools: [foss2022a-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_opt_autotools: [foss2023a-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_autotools: [foss2023a-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_autotools: [foss2023b-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
intel_autotools: [intel2023a-serial] 1.645947716000000e+01 7.499999981064320e-07 3.472222213455703e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_omp_autotools: [foss2023a-serial] 1.645947715000000e+01 7.400000008317420e-07 3.425925929776583e-01 PASS
intel_omp_autotools: [intel2022a-serial] 1.645947709000000e+01 6.799999994200334e-07 3.148148145463118e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
intel_omp_autotools: [intel2023a-serial] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_debug_autotools: [foss2023a-serial] 1.645947735000000e+01 9.399999996162478e-07 4.351851850075221e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_ppc_autotools: [foss2022a-serial] 1.645947712000000e+01 7.099999983495309e-07 3.287037029395976e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 1.645947658000000e+01 1.699999998550084e-07 7.870370363657794e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] 1.645947716000000e+01 7.499999981064320e-07 3.472222213455703e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 1.645947717000000e+01 7.599999989338357e-07 3.518518513582573e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 1.645947708000000e+01 6.699999985926297e-07 3.101851845336249e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 1.645947659000000e+01 1.800000006824121e-07 8.333333364926485e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 1.645947708000000e+01 6.699999985926297e-07 3.101851845336249e-01 PASS