Match comparison for Exchange energy (match type 28835)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.643760188000000e+01 | 1.430000000000000e-02 | -1.645058061882353e+01 | 2.124438829187230e-05 | -1.645057821500000e+01 | 4.121499999953926e-05 | 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: -16.43760188, precision: 0.0143| Run | Value | Difference | Relative difference | Status |
| intel-serial: [intel2023a-serial] | -1.645059335000000e+01 | -1.299146999999934e-02 | -9.084944055943593e-01 | PASS |
| foss-serial: [foss2023a-serial] | -1.645058605000000e+01 | -1.298416999999930e-02 | -9.079839160838667e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -1.645058605000000e+01 | -1.298416999999930e-02 | -9.079839160838667e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -1.645059201000000e+01 | -1.299013000000215e-02 | -9.084006993008499e-01 | PASS |
| ppc: [foss2023a-serial] | -1.645055009000000e+01 | -1.294821000000113e-02 | -9.054692307693095e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -1.645058106000000e+01 | -1.297918000000209e-02 | -9.076349650351111e-01 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -1.645058106000000e+01 | -1.297918000000209e-02 | -9.076349650351111e-01 | PASS |
| intel-parallel: [intel2023a-mpi] | -1.645053700000000e+01 | -1.293512000000163e-02 | -9.045538461539603e-01 | PASS |
| foss-parallel: [foss2023a-mpi] | -1.645058106000000e+01 | -1.297918000000209e-02 | -9.076349650351111e-01 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -1.645058373000000e+01 | -1.298185000000274e-02 | -9.078216783218697e-01 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -1.645057296000000e+01 | -1.297107999999980e-02 | -9.070685314685176e-01 | PASS |
| address-sanitizer: [foss2023a-serial, ci-foss-full] | -1.645058605000000e+01 | -1.298416999999930e-02 | -9.079839160838667e-01 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -1.645058106000000e+01 | -1.297918000000209e-02 | -9.076349650351111e-01 | PASS |
| intel-serial-debug: [intel2023a-serial] | -1.645059335000000e+01 | -1.299146999999934e-02 | -9.084944055943593e-01 | PASS |
| intel-parallel-debug: [intel2023a-mpi] | -1.645053700000000e+01 | -1.293512000000163e-02 | -9.045538461539603e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -1.645060921000000e+01 | -1.300733000000065e-02 | -9.096034965035419e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -1.645061943000000e+01 | -1.301755000000071e-02 | -9.103181818182315e-01 | PASS |