Match comparison for Hartree energy (match type 23860)

Commits > Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a > Input 25-Fe_polarized.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
6.510589381000000e+01 3.000000000000000e-06 6.510589426300001e+01 4.402056333096946e-07 6.510589414500001e+01 1.094999994677437e-06 PASS

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Detailed information

Reference: 65.10589381, precision: 0.000003
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_min_autotools: [foss2022a-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_min_autotools: [foss2023a-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_min_autotools: [foss2023b-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_opt_autotools: [foss2023a-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_autotools: [foss2022a-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_autotools: [foss2023b-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
intel_autotools: [intel2023a-serial] 6.510589385999999e+01 4.999999703159119e-08 1.666666567719706e-02 PASS
foss_autotools: [foss2023a-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_debug_autotools: [foss2023a-serial] 6.510589462999999e+01 8.199999967928306e-07 2.733333322642769e-01 PASS
foss_omp_autotools: [foss2023a-serial] 6.510589493000001e+01 1.120000007404087e-06 3.733333358013624e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
intel_omp_autotools: [intel2022a-serial] 6.510589395000000e+01 1.399999973727972e-07 4.666666579093241e-02 PASS
intel_omp_autotools: [intel2023a-serial] 6.510589432000000e+01 5.100000066704524e-07 1.700000022234841e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_ppc_autotools: [foss2022a-serial] 6.510589409000001e+01 2.800000089564492e-07 9.333333631881638e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 6.510589401999999e+01 2.099999960591958e-07 6.999999868639861e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] 6.510589524000000e+01 1.429999997526465e-06 4.766666658421551e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 6.510589453000000e+01 7.200000027296483e-07 2.400000009098827e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 6.510589305000001e+01 -7.599999918284084e-07 -2.533333306094694e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 6.510589358999999e+01 -2.200000039920269e-07 -7.333333466400897e-02 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 6.510589383000000e+01 2.000000165480742e-08 6.666667218269140e-03 PASS