Match comparison for Intersite Occupation Si2 NN9 s-s (match type 30022)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 4.513000000000000e-05 | 4.810000000000000e-07 | 4.509129032258064e-05 | 1.736550817250997e-08 | 4.506500000000000e-05 | 5.500000000000201e-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: 0.00004513, precision: 0.000000481| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_min_autotools: [foss2023a-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_autotools: [foss2022a-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_autotools: [foss2023b-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| intel_autotools: [intel2023a-serial] | 4.511000000000000e-05 | -2.000000000000320e-08 | -4.158004158004822e-02 | PASS |
| foss_autotools: [foss2023a-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 4.510000000000000e-05 | -3.000000000000479e-08 | -6.237006237007234e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 4.508000000000000e-05 | -5.000000000000122e-08 | -1.039501039501065e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 4.501000000000000e-05 | -1.200000000000056e-07 | -2.494802494802612e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 4.511000000000000e-05 | -2.000000000000320e-08 | -4.158004158004822e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 4.512000000000000e-05 | -1.000000000000160e-08 | -2.079002079002411e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 4.510000000000000e-05 | -3.000000000000479e-08 | -6.237006237007234e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 4.509000000000000e-05 | -4.000000000000639e-08 | -8.316008316009645e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 4.512000000000000e-05 | -1.000000000000160e-08 | -2.079002079002411e-02 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | 4.510000000000000e-05 | -3.000000000000479e-08 | -6.237006237007234e-02 | PASS |