Match comparison for Born charge 5 XX w=0.0 (match type 23041)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.479100000000001e-02 | 2.740000000000000e-05 | -5.824912500000000e-02 | 9.505537056598906e-03 | -7.226900000000000e-02 | 1.747800000000000e-02 | FAIL |
Checks for this match
- MPI builders have different values.
- GPU builders have different values. Intel® builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.054791000000000006, precision: 0.0000274| Run | Value | Difference | Relative difference | Status |
| intel-serial: [intel2023a-serial] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| foss-serial: [foss2023a-serial] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| foss-serial-debug: [foss2023a-serial] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| ppc: [foss2023a-serial] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| intel-parallel: [intel2023a-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| foss-parallel: [foss2023a-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| address-sanitizer: [foss2023a-serial, ci-foss-full] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| intel-serial-debug: [intel2023a-serial] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| intel-parallel-debug: [intel2023a-mpi] | -5.479100000000000e-02 | 6.938893903907228e-18 | 2.532443030623076e-13 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -8.974699999999999e-02 | -3.495599999999999e-02 | -1.275766423357664e+03 | FAIL |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -7.516500000000000e-02 | -2.037399999999999e-02 | -7.435766423357661e+02 | FAIL |