Match comparison for Born charge diff w=0.0 (match type 22436)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.902100000000001e-02 | 1.450000000000000e-05 | 2.541908000000000e-02 | 1.764573218865117e-02 | -1.600300000000000e-02 | 4.502400000000000e-02 | FAIL |
Checks for this match
- Precision seems too large.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 0.029021000000000005, precision: 0.0000145| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-opt-full: [foss2023a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-serial-full: [foss2023a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-serial-full: [foss2023b-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-ppc: [foss2022a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-serial-min: [foss2023a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-serial-min: [foss2023b-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-serial-debug: [foss2023a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-omp-full: [foss2023a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-mpi-full: [foss2023a-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| intel-serial: [intel2023a-serial] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| foss-serial-min: [foss2022a-serial] | -6.102700000000000e-02 | -9.004800000000000e-02 | -6.210206896551725e+03 | FAIL |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | 2.902100000000000e-02 | -3.469446951953614e-18 | -2.392722035830079e-13 | PASS |