Match comparison for Forces [step 20] (match type 17508)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 7.965856691524141e-02 | 5.140000000000000e-15 | 7.965856691524188e-02 | 1.361726905551094e-15 | 7.965856691524298e-02 | 3.108624468950438e-15 | 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: 0.07965856691524141, precision: 0.00000000000000514| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2022a_serial_min | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2023a_serial_opt | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2022a_serial | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2023a_serial | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2023b_serial | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2022a_ppc | 7.965856691523987e-02 | -1.540434446667405e-15 | -2.996954176395729e-01 | PASS |
| spack_foss-2022a_mpi_min | 7.965856691524209e-02 | 6.800116025829084e-16 | 1.322979771562079e-01 | PASS |
| spack_foss-2023a_mpi_min | 7.965856691524209e-02 | 6.800116025829084e-16 | 1.322979771562079e-01 | PASS |
| spack_foss-2023a_mpi_opt | 7.965856691524298e-02 | 1.568190022283034e-15 | 3.050953350745202e-01 | PASS |
| spack_foss-2023a_serial_debug | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2023a_serial_omp | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| cmake_foss_2022a_full_mpi | 7.965856691524298e-02 | 1.568190022283034e-15 | 3.050953350745202e-01 | PASS |
| spack_foss-2022a_mpi | 7.965856691524209e-02 | 6.800116025829084e-16 | 1.322979771562079e-01 | PASS |
| spack_foss-2023a_mpi | 7.965856691524209e-02 | 6.800116025829084e-16 | 1.322979771562079e-01 | PASS |
| spack_foss-2023a_mpi_debug | 7.965856691524209e-02 | 6.800116025829084e-16 | 1.322979771562079e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 7.965856691524609e-02 | 4.676814491233472e-15 | 9.098860877886132e-01 | PASS |
| spack_foss-2023a_mpi_omp | 7.965856691524253e-02 | 1.124100812432971e-15 | 2.186966561153640e-01 | PASS |
| spack_foss-2022a_cuda_serial | 7.965856691524520e-02 | 3.788636071533347e-15 | 7.370887298703009e-01 | PASS |
| cmake_foss_2022a_full_serial | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_intel-2023a_serial | 7.965856691524031e-02 | -1.096345236817342e-15 | -2.132967386804168e-01 | PASS |
| spack_intel-2022a_serial_omp | 7.965856691523987e-02 | -1.540434446667405e-15 | -2.996954176395729e-01 | PASS |
| spack_intel-2023a_serial_omp | 7.965856691523987e-02 | -1.540434446667405e-15 | -2.996954176395729e-01 | PASS |
| spack_intel-2023a_impi | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_intel-2022a_impi_omp | 7.965856691524165e-02 | 2.359223927328458e-16 | 4.589929819705171e-02 | PASS |
| spack_foss-2023a_valgrind | 7.965856691524076e-02 | -6.522560269672795e-16 | -1.268980597212606e-01 | PASS |