Match comparison for Forces [step 1] (match type 17471)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
8.537492460197621e-02 | 6.290000000000000e-15 | 8.537492460197600e-02 | 2.507787040014940e-15 | 8.537492460197882e-02 | 6.217248937900877e-15 | FAIL |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 0.08537492460197621, precision: 0.00000000000000629Run | Value | Difference | Relative difference | Status |
spack_foss-2022a_serial_min | 8.537492460197482e-02 | -1.387778780781446e-15 | -2.206325565630279e-01 | PASS |
spack_foss-2023a_serial_min | 8.537492460197482e-02 | -1.387778780781446e-15 | -2.206325565630279e-01 | PASS |
spack_foss-2023a_serial | 8.537492460197482e-02 | -1.387778780781446e-15 | -2.206325565630279e-01 | PASS |
spack_foss-2022a_serial | 8.537492460197482e-02 | -1.387778780781446e-15 | -2.206325565630279e-01 | PASS |
spack_foss-2023a_serial_opt | 8.537492460197527e-02 | -9.436895709313831e-16 | -1.500301384628590e-01 | PASS |
spack_foss-2023b_serial | 8.537492460197482e-02 | -1.387778780781446e-15 | -2.206325565630279e-01 | PASS |
spack_foss-2022a_ppc | 8.537492460198504e-02 | 8.826273045769994e-15 | 1.403223059740858e+00 | FAIL |
spack_foss-2022a_mpi_min | 8.537492460197438e-02 | -1.831867990631508e-15 | -2.912349746631969e-01 | PASS |
spack_foss-2023a_mpi_min | 8.537492460197438e-02 | -1.831867990631508e-15 | -2.912349746631969e-01 | PASS |
spack_foss-2023a_serial_omp | 8.537492460197704e-02 | 8.326672684688674e-16 | 1.323795339378168e-01 | PASS |
spack_foss-2023a_serial_debug | 8.537492460197482e-02 | -1.387778780781446e-15 | -2.206325565630279e-01 | PASS |
spack_foss-2023a_mpi_opt | 8.537492460197704e-02 | 8.326672684688674e-16 | 1.323795339378168e-01 | PASS |
spack_foss-2022a_mpi | 8.537492460197438e-02 | -1.831867990631508e-15 | -2.912349746631969e-01 | PASS |
spack_foss-2023a_mpi | 8.537492460197438e-02 | -1.831867990631508e-15 | -2.912349746631969e-01 | PASS |
spack_foss-2022a_cuda_serial | 8.537492460197926e-02 | 3.053113317719180e-15 | 4.853916244386615e-01 | PASS |
spack_foss-2023a_mpi_debug | 8.537492460197438e-02 | -1.831867990631508e-15 | -2.912349746631969e-01 | PASS |
spack_foss-2023a_mpi_omp | 8.537492460197837e-02 | 2.164934898019055e-15 | 3.441867882383235e-01 | PASS |
spack_foss-2022a_cuda_mpi_omp | 8.537492460197926e-02 | 3.053113317719180e-15 | 4.853916244386615e-01 | PASS |
spack_intel-2023a_serial | 8.537492460197571e-02 | -4.996003610813204e-16 | -7.942772036269005e-02 | PASS |
spack_intel-2022a_serial_omp | 8.537492460197615e-02 | -5.551115123125783e-17 | -8.825302262521118e-03 | PASS |
spack_intel-2023a_serial_omp | 8.537492460197615e-02 | -5.551115123125783e-17 | -8.825302262521118e-03 | PASS |
spack_intel-2022a_impi_omp | 8.537492460197749e-02 | 1.276756478318930e-15 | 2.029819520379857e-01 | PASS |
spack_intel-2023a_impi | 8.537492460197393e-02 | -2.275957200481571e-15 | -3.618373927633658e-01 | PASS |
spack_foss-2023a_valgrind | 8.537492460197260e-02 | -3.608224830031759e-15 | -5.736446470638726e-01 | PASS |