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 | 6.510589397962963e+01 | 6.606589395232858e-07 | 6.510589434500000e+01 | 1.175000001296667e-06 | PASS |
Checks for this match
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Detailed information
Reference: 65.10589381, precision: 0.000005| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_cuda_serial | 6.510589376999999e+01 | -4.000000330961484e-08 | -8.000000661922968e-03 | PASS |
| spack_foss-2022a_ppc | 6.510589426999999e+01 | 4.599999954280065e-07 | 9.199999908560129e-02 | PASS |
| cmake_foss_2022a_full_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_mpi_min | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| spack_foss-2023a_mpi_min | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| cmake_foss_2022a_min_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_mpi | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| spack_foss-2023a_mpi | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| cmake_foss_2022a_min_mpi | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| spack_foss-2023a_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 6.510589552000000e+01 | 1.710000006482915e-06 | 3.420000012965829e-01 | PASS |
| spack_foss-2023a_mpi_debug | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| spack_foss-2023a_mpi_opt | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| spack_foss-2023a_serial_min | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2023a_serial_debug | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2023a_serial_opt | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2023a_mpi_omp | 6.510589404000000e+01 | 2.299999977140033e-07 | 4.599999954280064e-02 | PASS |
| spack_foss-2023b_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2023a_serial_omp | 6.510589458000000e+01 | 7.699999997612395e-07 | 1.539999999522479e-01 | PASS |
| spack_intel-2023a_serial | 6.510589485000000e+01 | 1.040000000784858e-06 | 2.080000001569715e-01 | PASS |
| spack_intel-2022a_serial_omp | 6.510589358999999e+01 | -2.200000039920269e-07 | -4.400000079840537e-02 | PASS |
| spack_intel-2023a_serial_omp | 6.510589438000000e+01 | 5.699999974240200e-07 | 1.139999994848040e-01 | PASS |
| spack_intel-2022a_impi_omp | 6.510589455000000e+01 | 7.400000043844557e-07 | 1.480000008768911e-01 | PASS |
| spack_intel-2023a_impi | 6.510589392999999e+01 | 1.199999957179898e-07 | 2.399999914359796e-02 | PASS |
| cmake_foss_2022a_full_mpi | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |