Match comparison for X Force Atom 1 [step 10] (match type 24691)
Commits >
Commit 1d082993d3bad72c6bb5f6456239111dd26ba4bd >
Input 22-td_move_ions_periodic.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.427031944168380e+00 | 8.179999999999999e-12 | -5.427031944168549e+00 | 1.163988232207305e-14 | -5.427031944168545e+00 | 1.421085471520200e-14 | PASS |
Checks for this match
- OpenMP builders have different values.
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Detailed information
Reference: -5.42703194416838, precision: 0.00000000000818| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -5.427031944168551e+00 | -1.705302565824240e-13 | -2.084721963110318e-02 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -5.427031944168559e+00 | -1.785238623597252e-13 | -2.182443305131115e-02 | PASS |
| cuda-mpi: [foss2022a-cuda-mpi] | -5.427031944168559e+00 | -1.785238623597252e-13 | -2.182443305131115e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -5.427031944168530e+00 | -1.501021529293212e-13 | -1.834989644612728e-02 | PASS |