Match comparison for Forces [step 20] (match type 17496)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 7.964818149493391e-02 | 5.370000000000000e-15 | 7.964818149493338e-02 | 1.643358712239704e-15 | 7.964818149493436e-02 | 4.440892098500626e-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: 0.07964818149493391, precision: 0.00000000000000537| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| spack_foss-2023a_serial_min | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| spack_foss-2022a_serial | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| spack_foss-2023a_serial | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| cmake_foss_2022a_full_serial | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_foss-2022a_ppc | 7.964818149492991e-02 | -3.996802888650564e-15 | -7.442835919274793e-01 | PASS |
| spack_foss-2023a_mpi_min | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_foss-2022a_mpi_min | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| cmake_foss_2022a_full_mpi | 7.964818149493391e-02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2023a_serial_debug | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| spack_foss-2023a_mpi_opt | 7.964818149493391e-02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_mpi | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_foss-2023a_mpi | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_foss-2022a_cuda_serial | 7.964818149493791e-02 | 3.996802888650564e-15 | 7.442835919274793e-01 | PASS |
| spack_foss-2023a_mpi_debug | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_foss-2023a_mpi_omp | 7.964818149493347e-02 | -4.440892098500626e-16 | -8.269817688083103e-02 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 7.964818149493880e-02 | 4.884981308350689e-15 | 9.096799456891412e-01 | PASS |
| spack_foss-2023a_serial_opt | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_foss-2023b_serial | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| spack_foss-2023a_serial_omp | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_intel-2023a_serial | 7.964818149493391e-02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_intel-2022a_serial_omp | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| spack_intel-2023a_serial_omp | 7.964818149493258e-02 | -1.332267629550188e-15 | -2.480945306424931e-01 | PASS |
| spack_intel-2023a_impi | 7.964818149493436e-02 | 4.440892098500626e-16 | 8.269817688083103e-02 | PASS |
| spack_intel-2022a_impi_omp | 7.964818149493302e-02 | -8.881784197001252e-16 | -1.653963537616621e-01 | PASS |
| spack_foss-2023a_valgrind | 7.964818149493391e-02 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |