Match comparison for Hartree energy (match type 23860)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 6.510589381000000e+01 | 5.000000000000000e-06 | 6.510589349315789e+01 | 8.680107512375377e-07 | 6.510589361500000e+01 | 1.315000005774891e-06 | PASS |
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Detailed information
Reference: 65.10589381, precision: 0.000005| Run | Value | Difference | Relative difference | Status |
| GCI_foss_min_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| cmake_foss_2022a_full_serial | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_foss-2023a_serial_min | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2022a_serial_min | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2022a_ppc | 6.510589493000001e+01 | 1.120000007404087e-06 | 2.240000014808174e-01 | PASS |
| spack_foss-2022a_serial | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | 6.510589444999999e+01 | 6.399999961104186e-07 | 1.279999992220837e-01 | PASS |
| spack_foss-2023a_serial | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| cmake_foss_2022a_min_mpi | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2022a_mpi_min | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_foss-2023a_mpi_min | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss_ppc_autotools: [foss2022a-serial] | 6.510589493000001e+01 | 1.120000007404087e-06 | 2.240000014808174e-01 | PASS |
| cmake_foss_2022a_full_mpi | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_foss-2023a_mpi_opt | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| cmake_foss_2022a_min_serial | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2023a_serial_debug | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2022a_mpi | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_foss-2023a_mpi | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2023a_mpi_debug | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_foss-2023a_mpi_omp | 6.510589449000000e+01 | 6.799999994200334e-07 | 1.359999998840067e-01 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 6.510589378000000e+01 | -2.999999537678377e-08 | -5.999999075356754e-03 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | 6.510589466000000e+01 | 8.500000063804691e-07 | 1.700000012760938e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_foss-2023a_serial_opt | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | 6.510589401999999e+01 | 2.099999960591958e-07 | 4.199999921183917e-02 | PASS |
| spack_foss-2023a_serial_omp | 6.510589401999999e+01 | 2.099999960591958e-07 | 4.199999921183917e-02 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_foss-2023b_serial | 6.510589392000000e+01 | 1.100000019960135e-07 | 2.200000039920269e-02 | PASS |
| spack_intel-2023a_serial | 6.510589466000000e+01 | 8.500000063804691e-07 | 1.700000012760938e-01 | PASS |
| spack_intel-2022a_serial_omp | 6.510589444999999e+01 | 6.399999961104186e-07 | 1.279999992220837e-01 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | 6.510589385999999e+01 | 4.999999703159119e-08 | 9.999999406318238e-03 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_intel-2023a_serial_omp | 6.510589385999999e+01 | 4.999999703159119e-08 | 9.999999406318238e-03 | PASS |
| GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | 6.510589354000000e+01 | -2.700000010236181e-07 | -5.400000020472361e-02 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | 6.510589432000000e+01 | 5.100000066704524e-07 | 1.020000013340905e-01 | PASS |
| spack_intel-2023a_impi | 6.510589432000000e+01 | 5.100000066704524e-07 | 1.020000013340905e-01 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | 6.510589449000000e+01 | 6.799999994200334e-07 | 1.359999998840067e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] | 6.510589229999999e+01 | -1.510000004145695e-06 | -3.020000008291390e-01 | PASS |
| spack_intel-2022a_impi_omp | 6.510589315000000e+01 | -6.599999977652260e-07 | -1.319999995530452e-01 | PASS |
| spack_foss-2022a_cuda_serial | 6.510589407000001e+01 | 2.600000073016417e-07 | 5.200000146032834e-02 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | 6.510589315000000e+01 | -6.599999977652260e-07 | -1.319999995530452e-01 | PASS |
| GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 6.510589408000000e+01 | 2.700000010236181e-07 | 5.400000020472361e-02 | PASS |