Match comparison for Exchange energy (match type 23683)
Commits >
Commit 648faf2c6f79684bb4504aeb1ba8c9cb14e3b2f7 >
Input 09-symmetrization_gga.02-spg143_sym.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.388670000000000e-01 | 2.190000000000000e-05 | -4.388674200000000e-01 | 5.551115123125783e-17 | -4.388674200000000e-01 | 0.000000000000000e+00 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -0.438867, precision: 0.0000219| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_serial_min | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_serial_opt | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2022a_serial | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_serial | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023b_serial | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2022a_ppc | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_mpi_min | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2022a_mpi_min | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2022a_cuda_serial | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_serial_omp | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_serial_debug | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_mpi_opt | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_mpi | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2022a_mpi | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_mpi_debug | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_foss-2023a_mpi_omp | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| cmake_foss_2022a_full_serial | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| cmake_foss_2022a_min_serial | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| cmake_foss_2022a_min_mpi | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| cmake_foss_2022a_full_mpi | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_intel-2023a_serial | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_intel-2022a_serial_omp | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_intel-2022a_impi_omp | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_intel-2023a_serial_omp | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |
| spack_intel-2023a_impi | -4.388674200000000e-01 | -4.200000000009751e-07 | -1.917808219182535e-02 | PASS |