Match comparison for Hartree energy (match type 29119)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.648505053000000e+01 | 5.000000000000000e+00 | 2.648438345767857e+01 | 4.221996927021327e-09 | 2.648438345500000e+01 | 5.000000413701855e-09 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 26.48505053, precision: 5.0| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_serial_min | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2022a_ppc | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| spack_foss-2022a_serial | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_serial | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_serial_opt | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023b_serial | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_mpi_min | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2022a_mpi_min | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_serial_omp | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2022a_mpi | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_mpi_opt | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_serial_debug | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_mpi | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_ppc_autotools: [foss2022a-serial] | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_mpi_debug | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_min_autotools: [foss2023a-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2023a_mpi_omp | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| cmake_foss_2022a_min_serial | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| cmake_foss_2022a_full_serial | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| cmake_foss_2022a_min_mpi | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_intel-2022a_impi_omp | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| cmake_foss_2022a_full_mpi | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| spack_intel-2023a_serial | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| spack_intel-2022a_serial_omp | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| spack_intel-2023a_impi | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| spack_foss-2022a_cuda_serial | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| spack_foss-2023a_valgrind | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| GCI_foss_valgrind_autotools: [foss2023a-serial] | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |
| GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | 2.648438346000000e+01 | -6.670699999986596e-04 | -1.334139999997319e-04 | PASS |
| GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | 2.648438345000000e+01 | -6.670799999994870e-04 | -1.334159999998974e-04 | PASS |