Match comparison for Hartree energy (match type 29779)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 6.122738745000000e+01 | 3.520000000000000e-07 | 6.122738754280000e+01 | 1.953155390472055e-07 | 6.122738748500000e+01 | 2.949999995394137e-07 | PASS |
Checks for this match
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Detailed information
Reference: 61.22738745, precision: 0.000000352| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | 6.122738778000000e+01 | 3.299999988826130e-07 | 9.374999968256051e-01 | PASS |
| spack_foss-2022a_ppc | 6.122738771000000e+01 | 2.600000001962144e-07 | 7.386363641937910e-01 | PASS |
| cmake_foss_2022a_min_serial | 6.122738778000000e+01 | 3.299999988826130e-07 | 9.374999968256051e-01 | PASS |
| cmake_foss_2022a_min_mpi | 6.122738735000000e+01 | -1.000000011686097e-07 | -2.840909124108231e-01 | PASS |
| cmake_foss_2022a_full_mpi | 6.122738720000000e+01 | -2.499999993688107e-07 | -7.102272709341213e-01 | PASS |
| spack_foss-2022a_mpi_min | 6.122738766000000e+01 | 2.099999960591958e-07 | 5.965908978954427e-01 | PASS |
| spack_foss-2022a_mpi | 6.122738766000000e+01 | 2.099999960591958e-07 | 5.965908978954427e-01 | PASS |
| spack_foss-2022a_serial | 6.122738756000000e+01 | 1.099999948905861e-07 | 3.124999854846196e-01 | PASS |
| spack_foss-2022a_serial_min | 6.122738756000000e+01 | 1.099999948905861e-07 | 3.124999854846196e-01 | PASS |
| spack_foss-2023a_mpi | 6.122738766000000e+01 | 2.099999960591958e-07 | 5.965908978954427e-01 | PASS |
| spack_foss-2023a_mpi_min | 6.122738766000000e+01 | 2.099999960591958e-07 | 5.965908978954427e-01 | PASS |
| spack_foss-2023a_serial_min | 6.122738756000000e+01 | 1.099999948905861e-07 | 3.124999854846196e-01 | PASS |
| spack_foss-2023a_serial | 6.122738756000000e+01 | 1.099999948905861e-07 | 3.124999854846196e-01 | PASS |
| spack_foss-2023a_mpi_opt | 6.122738720000000e+01 | -2.499999993688107e-07 | -7.102272709341213e-01 | PASS |
| spack_foss-2023a_mpi_debug | 6.122738766000000e+01 | 2.099999960591958e-07 | 5.965908978954427e-01 | PASS |
| spack_foss-2023a_serial_opt | 6.122738778000000e+01 | 3.299999988826130e-07 | 9.374999968256051e-01 | PASS |
| spack_foss-2023b_serial | 6.122738756000000e+01 | 1.099999948905861e-07 | 3.124999854846196e-01 | PASS |
| spack_foss-2023a_serial_debug | 6.122738756000000e+01 | 1.099999948905861e-07 | 3.124999854846196e-01 | PASS |
| spack_foss-2023a_serial_omp | 6.122738769000000e+01 | 2.399999985414070e-07 | 6.818181776744516e-01 | PASS |
| spack_intel-2022a_serial_omp | 6.122738719000000e+01 | -2.600000001962144e-07 | -7.386363641937910e-01 | PASS |
| spack_foss-2023a_mpi_omp | 6.122738776000000e+01 | 3.099999972278056e-07 | 8.806818103062659e-01 | PASS |
| spack_intel-2023a_serial | 6.122738729000000e+01 | -1.599999990276046e-07 | -4.545454517829678e-01 | PASS |
| spack_intel-2023a_impi | 6.122738733000000e+01 | -1.200000028234172e-07 | -3.409090989301624e-01 | PASS |
| spack_intel-2023a_serial_omp | 6.122738722000000e+01 | -2.300000048194306e-07 | -6.534091046006552e-01 | PASS |
| spack_intel-2022a_impi_omp | 6.122738763000000e+01 | 1.800000006824121e-07 | 5.113636383023070e-01 | PASS |