Match comparison for Hartree energy (match type 26101)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
4.244778686000000e+01 | 1.190000000000000e-06 | 4.244778737684209e+01 | 4.574074836978149e-07 | 4.244778745000000e+01 | 5.899999990788274e-07 | PASS |
Checks for this match
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Detailed information
Reference: 42.44778686, precision: 0.00000119Run | Value | Difference | Relative difference | Status |
foss-serial-zen4: [foss2023a-serial] | 4.244778804000000e+01 | 1.179999998157655e-06 | 9.915966371072729e-01 | PASS |
intel-serial: [intel2023a-serial] | 4.244778687000000e+01 | 1.000000082740371e-08 | 8.403362039835049e-03 | PASS |
foss-serial-debug: [foss2023a-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
intel-parallel: [intel2023a-mpi] | 4.244778768000000e+01 | 8.199999967928306e-07 | 6.890756275570005e-01 | PASS |
intel-min-parallel: [intel2022a-mpi] | 4.244778789000000e+01 | 1.029999999957454e-06 | 8.655462184516418e-01 | PASS |
foss-parallel-zen4: [foss2023a-mpi] | 4.244778698000000e+01 | 1.199999957179898e-07 | 1.008403325361259e-01 | PASS |
foss-min-parallel-zen4: [foss2023a-mpi] | 4.244778778000000e+01 | 9.199999979614404e-07 | 7.731092419844037e-01 | PASS |
autotools_foss_mpi_omp: [foss2023a-mpi] | 4.244778693000000e+01 | 6.999999868639861e-08 | 5.882352830789799e-02 | PASS |
foss-parallel-debug: [foss2023a-mpi] | 4.244778693000000e+01 | 6.999999868639861e-08 | 5.882352830789799e-02 | PASS |
foss-serial: [foss2023a-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
ppc: [foss2023a-serial] | 4.244778771000000e+01 | 8.499999992750418e-07 | 7.142857136765056e-01 | PASS |
autotools_intel_mpi_omp: [intel2023a-mpi] | 4.244778768000000e+01 | 8.199999967928306e-07 | 6.890756275570005e-01 | PASS |
intel-serial-debug: [intel2023a-serial] | 4.244778687000000e+01 | 1.000000082740371e-08 | 8.403362039835049e-03 | PASS |
foss-parallel: [foss2023a-mpi] | 4.244778693000000e+01 | 6.999999868639861e-08 | 5.882352830789799e-02 | PASS |
foss-min-parallel: [foss2023b-mpi] | 4.244778785000000e+01 | 9.899999966478390e-07 | 8.319327702923016e-01 | PASS |
intel-parallel-debug: [intel2023a-mpi] | 4.244778768000000e+01 | 8.199999967928306e-07 | 6.890756275570005e-01 | PASS |
cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | 4.244778690000000e+01 | 3.999999620418748e-08 | 3.361344218839284e-02 | PASS |
foss-min-parallel: [foss2022a-mpi] | 4.244778785000000e+01 | 9.899999966478390e-07 | 8.319327702923016e-01 | PASS |
cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | 4.244778787000000e+01 | 1.009999998302646e-06 | 8.487394943719717e-01 | PASS |