Match comparison for Exchange energy (match type 28155)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -8.817965120000000e+00 | 4.410000000000000e-07 | -8.817965133636363e+00 | 1.149919193230207e-08 | -8.817965149999999e+00 | 2.000000076662900e-08 | PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -8.81796512, precision: 0.000000441| Run | Value | Difference | Relative difference | Status |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -8.817965170000001e+00 | -5.000000058430487e-08 | -1.133786861322106e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -8.817965170000001e+00 | -5.000000058430487e-08 | -1.133786861322106e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-serial-min: [foss2023b-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-serial-min: [foss2023a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-opt-full: [foss2023a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-serial-full: [foss2023b-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-serial-full: [foss2023a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| intel_autotools: [intel2023a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-ppc: [foss2022a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-serial-debug: [foss2023a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -8.817965129999999e+00 | -9.999999051046871e-09 | -2.267573480963009e-02 | PASS |