Match comparison for Hartree energy (match type 30235)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 3.988936987400000e+03 | 1.800000000000000e-05 | 3.988936995160351e+03 | 1.127490816050023e-05 | 3.988936987765000e+03 | 1.591499994901824e-05 | PASS |
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Detailed information
Reference: 3988.9369874000004, precision: 0.000018| Run | Value | Difference | Relative difference | Status |
| GCI_foss_ppc_autotools: [foss2022a-serial] | 3.988937003600000e+03 | 1.619999966351315e-05 | 8.999999813062863e-01 | PASS |
| cmake_foss_2022a_full_serial | 3.988936974010000e+03 | -1.339000027655857e-05 | -7.438889042532537e-01 | PASS |
| spack_foss-2022a_ppc | 3.988937003600000e+03 | 1.619999966351315e-05 | 8.999999813062863e-01 | PASS |
| spack_foss-2023a_serial_opt | 3.988936974010000e+03 | -1.339000027655857e-05 | -7.438889042532537e-01 | PASS |
| cmake_foss_2022a_min_serial | 3.988936974010000e+03 | -1.339000027655857e-05 | -7.438889042532537e-01 | PASS |
| cmake_foss_2022a_min_mpi | 3.988937001980000e+03 | 1.457999951526290e-05 | 8.099999730701610e-01 | PASS |
| cmake_foss_2022a_full_mpi | 3.988937000830000e+03 | 1.342999985354254e-05 | 7.461111029745855e-01 | PASS |
| spack_foss-2022a_mpi | 3.988936972720000e+03 | -1.468000027671224e-05 | -8.155555709284574e-01 | PASS |
| spack_foss-2022a_mpi_min | 3.988936992630000e+03 | 5.229999715083977e-06 | 2.905555397268876e-01 | PASS |
| spack_foss-2022a_serial | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| GCI_foss_min_autotools: [foss2023a-serial] | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2022a_serial_min | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2023a_serial | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2023a_mpi_min | 3.988936992630000e+03 | 5.229999715083977e-06 | 2.905555397268876e-01 | PASS |
| spack_foss-2023a_mpi | 3.988937003540000e+03 | 1.613999984328984e-05 | 8.966666579605468e-01 | PASS |
| spack_foss-2023a_serial_min | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2023a_mpi_opt | 3.988936990200000e+03 | 2.799999492708594e-06 | 1.555555273726996e-01 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2023a_serial_debug | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2023b_serial | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2023a_serial_omp | 3.988936971850000e+03 | -1.555000017106067e-05 | -8.638888983922597e-01 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | 3.988936971850000e+03 | -1.555000017106067e-05 | -8.638888983922597e-01 | PASS |
| spack_foss-2023a_mpi_debug | 3.988936974100000e+03 | -1.330000031884992e-05 | -7.388889066027736e-01 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | 3.988936974010000e+03 | -1.339000027655857e-05 | -7.438889042532537e-01 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_intel-2022a_serial_omp | 3.988937003560000e+03 | 1.615999963178183e-05 | 8.977777573212127e-01 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| spack_foss-2023a_mpi_omp | 3.988937002470000e+03 | 1.506999979028478e-05 | 8.372222105713768e-01 | PASS |
| spack_intel-2023a_serial | 3.988937002310000e+03 | 1.490999966335949e-05 | 8.283333146310825e-01 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | 3.988937003510000e+03 | 1.610999970580451e-05 | 8.949999836558062e-01 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | 3.988937002310000e+03 | 1.490999966335949e-05 | 8.283333146310825e-01 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | 3.988937003560000e+03 | 1.615999963178183e-05 | 8.977777573212127e-01 | PASS |
| spack_intel-2023a_impi | 3.988936998830000e+03 | 1.142999963121838e-05 | 6.349999795121322e-01 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | 3.988936996510000e+03 | 9.109999609790975e-06 | 5.061110894328319e-01 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | 3.988936999680000e+03 | 1.227999973707483e-05 | 6.822222076152684e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | 3.988936974010000e+03 | -1.339000027655857e-05 | -7.438889042532537e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | 3.988936974010000e+03 | -1.339000027655857e-05 | -7.438889042532537e-01 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | 3.988937002600000e+03 | 1.519999977972475e-05 | 8.444444322069304e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | 3.988937003580000e+03 | 1.617999942027382e-05 | 8.988888566818787e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | 3.988936977070000e+03 | -1.033000035022269e-05 | -5.738889083457049e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | 3.988936977070000e+03 | -1.033000035022269e-05 | -5.738889083457049e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | 3.988937003120000e+03 | 1.571999973748461e-05 | 8.733333187491452e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | 3.988937003680000e+03 | 1.627999972697580e-05 | 9.044444292764334e-01 | PASS |
| GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] | 3.988937003160000e+03 | 1.575999976921594e-05 | 8.755555427342188e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | 3.988937003460000e+03 | 1.605999977982719e-05 | 8.922222099903997e-01 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | 3.988937003560000e+03 | 1.615999963178183e-05 | 8.977777573212127e-01 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | 3.988937003040000e+03 | 1.563999967402196e-05 | 8.688888707789980e-01 | PASS |
| GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] | 3.988937003470000e+03 | 1.606999967407319e-05 | 8.927777596707326e-01 | PASS |
| spack_intel-2023a_serial_omp | 3.988936996510000e+03 | 9.109999609790975e-06 | 5.061110894328319e-01 | PASS |
| spack_intel-2022a_impi_omp | 3.988937003380000e+03 | 1.597999971636455e-05 | 8.877777620202525e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 3.988937002850000e+03 | 1.544999986435869e-05 | 8.583333257977048e-01 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | 3.988937003670000e+03 | 1.626999983272981e-05 | 9.038888795961004e-01 | PASS |
| spack_foss-2022a_cuda_serial | 3.988936998890000e+03 | 1.148999945144169e-05 | 6.383333028578717e-01 | PASS |
| GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | 3.988936998890000e+03 | 1.148999945144169e-05 | 6.383333028578717e-01 | PASS |
| GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 3.988937003650000e+03 | 1.624999958949047e-05 | 9.027777549716929e-01 | PASS |