Match comparison for Occupation Ni2 up-down 3d5 (match type 30817)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.311370800000000e-01 | 4.200000000000000e-06 | -4.311367803571429e-01 | 1.595861196722990e-07 | -4.311366050000000e-01 | 3.550000000074327e-07 | 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: -0.43113708, precision: 0.0000042| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_min_autotools: [foss2023a-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_autotools: [foss2022a-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_autotools: [foss2023a-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| intel_autotools: [intel2023a-serial] | -4.311367800000000e-01 | 3.000000000086267e-07 | 7.142857143062541e-02 | PASS |
| foss_autotools: [foss2023b-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -4.311367800000000e-01 | 3.000000000086267e-07 | 7.142857143062541e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -4.311368600000000e-01 | 2.199999999952240e-07 | 5.238095237981525e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -4.311368000000000e-01 | 2.800000000191538e-07 | 6.666666667122710e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -4.311368800000000e-01 | 2.000000000057511e-07 | 4.761904762041694e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -4.311367500000000e-01 | 3.299999999928360e-07 | 7.857142856972286e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -4.311369600000000e-01 | 1.199999999923484e-07 | 2.857142856960678e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -4.311368600000000e-01 | 2.199999999952240e-07 | 5.238095237981525e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -4.311367400000000e-01 | 3.399999999875725e-07 | 8.095238094942202e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -4.311368300000000e-01 | 2.499999999794333e-07 | 5.952380951891271e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -4.311362600000000e-01 | 8.200000000124774e-07 | 1.952380952410661e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -4.311362500000000e-01 | 8.300000000072139e-07 | 1.976190476207652e-01 | PASS |