Match comparison for Born charge xx (match type 12627)
Commits >
Commit 7a2379c5947d58fb2522a5e1a0c4903dfa35a523 >
Input 05-polarizability.03-finite-diff.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.294000000000000e-03 | 1.150000000000000e-05 | 2.294925925925926e-03 | 2.618914004394968e-07 | 2.294500000000000e-03 | 5.000000000000664e-07 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: 0.002294, precision: 0.0000115| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_mpi_debug | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_mpi_omp | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| cmake_foss_2022a_min_serial | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| cmake_foss_2022a_full_serial | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| cmake_foss_2022a_min_mpi | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| cmake_foss_2022a_full_mpi | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_intel-2023a_serial | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_intel-2022a_impi_omp | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_intel-2022a_serial_omp | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_intel-2023a_serial_omp | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_intel-2023a_impi | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 2.294000000000000e-03 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_min | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_serial_min | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2022a_serial | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_serial | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_serial_opt | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023b_serial | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2022a_ppc | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2022a_cuda_serial | 2.294000000000000e-03 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2023a_mpi_min | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2022a_mpi_min | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_serial_omp | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_serial_debug | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_mpi_opt | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2022a_mpi | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |
| spack_foss-2023a_mpi | 2.295000000000000e-03 | 1.000000000000133e-06 | 8.695652173914198e-02 | PASS |