Match comparison for Dynamical Matrix Entry (match type 12527)
Commits >
Commit 119356330ffc33ec037b7259f31bc868121af1f1 >
Input 06-vib_modes_fd.01-vib_modes_fd.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.843032480160000e-02 | 2.640000000000000e-12 | -1.843032480059375e-02 | 8.663633007619843e-13 | -1.843032480190000e-02 | 1.899999255150497e-12 | PASS |
Checks for this match
- OpenMP builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.018430324801600003, precision: 0.00000000000264| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -1.843032480070000e-02 | 9.000022949123831e-13 | 3.409099601940845e-01 | PASS |
| spack_foss-2023a_serial_min | -1.843032480070000e-02 | 9.000022949123831e-13 | 3.409099601940845e-01 | PASS |
| spack_foss-2022a_serial_opt | -1.843032480060000e-02 | 1.000002164408542e-12 | 3.787886986395993e-01 | PASS |
| spack_foss-2022a_serial | -1.843032480070000e-02 | 9.000022949123831e-13 | 3.409099601940845e-01 | PASS |
| spack_foss-2022a_ppc | -1.843032480380000e-02 | -2.199997128915498e-12 | -8.333322458013251e-01 | PASS |
| spack_foss-2022a_mpi_min | -1.843032480040000e-02 | 1.200001903400860e-12 | 4.545461755306289e-01 | PASS |
| spack_foss-2023a_mpi_min | -1.843032480040000e-02 | 1.200001903400860e-12 | 4.545461755306289e-01 | PASS |
| spack_foss-2022a_mpi_opt | -1.843032480000000e-02 | 1.600001381385496e-12 | 6.060611293126880e-01 | PASS |
| spack_foss-2022a_serial_debug | -1.843032480070000e-02 | 9.000022949123831e-13 | 3.409099601940845e-01 | PASS |
| spack_intel-2022a_serial_omp | -1.843032480000000e-02 | 1.600001381385496e-12 | 6.060611293126880e-01 | PASS |
| spack_foss-2022a_mpi | -1.843032480040000e-02 | 1.200001903400860e-12 | 4.545461755306289e-01 | PASS |
| spack_intel-2023a_impi | -1.843032480040000e-02 | 1.200001903400860e-12 | 4.545461755306289e-01 | PASS |
| spack_foss-2022a_mpi_debug | -1.843032480040000e-02 | 1.200001903400860e-12 | 4.545461755306289e-01 | PASS |
| spack_foss-2022a_cuda_serial | -1.843032480030000e-02 | 1.300001772897019e-12 | 4.924249139761436e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -1.843032480000000e-02 | 1.600001381385496e-12 | 6.060611293126880e-01 | PASS |
| spack_intel-2022a_impi_omp | -1.843032480000000e-02 | 1.600001381385496e-12 | 6.060611293126880e-01 | PASS |