Match comparison for X Force Atom 1 [step 20] (match type 24692)
Commits >
Commit adc9f2ea8065b70b337db7e35c2a67771b9e5a60 >
Input 22-td_move_ions_periodic.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.668028015450004e+00 | 8.120000000000000e-12 | -4.668028015450064e+00 | 1.664594223704025e-14 | -4.668028015450076e+00 | 2.753353101070388e-14 | PASS |
Checks for this match
- OpenMP builders have different values.
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Detailed information
Reference: -4.668028015450004, precision: 0.00000000000812| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -4.668028015450063e+00 | -5.950795411990839e-14 | -7.328565778313841e-03 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -4.668028015450060e+00 | -5.595524044110789e-14 | -6.891039463190626e-03 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -4.668028015450074e+00 | -7.016609515630989e-14 | -8.641144723683485e-03 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -4.668028015450083e+00 | -7.904787935331115e-14 | -9.734960511491520e-03 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss-serial-min: [foss2023a-serial] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss-serial-min: [foss2022a-serial] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss-serial-min: [foss2023b-serial] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss-serial-full: [foss2023b-serial] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| intel_autotools: [intel2023a-serial] | -4.668028015450060e+00 | -5.595524044110789e-14 | -6.891039463190626e-03 | PASS |
| foss-opt-full: [foss2023a-serial] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss-serial-full: [foss2023a-serial] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss-ppc: [foss2022a-serial] | -4.668028015450052e+00 | -4.796163466380676e-14 | -5.906605254163394e-03 | PASS |
| foss-serial-debug: [foss2023a-serial] | -4.668028015450048e+00 | -4.440892098500626e-14 | -5.469078939040180e-03 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -4.668028015450057e+00 | -5.329070518200751e-14 | -6.562894726848216e-03 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -4.668028015450097e+00 | -9.325873406851315e-14 | -1.148506577198438e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -4.668028015450057e+00 | -5.329070518200751e-14 | -6.562894726848216e-03 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -4.668028015450097e+00 | -9.325873406851315e-14 | -1.148506577198438e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | -4.668028015450085e+00 | -8.171241461241152e-14 | -1.006310524783393e-02 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -4.668028015450057e+00 | -5.329070518200751e-14 | -6.562894726848216e-03 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -4.668028015450057e+00 | -5.329070518200751e-14 | -6.562894726848216e-03 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -4.668028015450066e+00 | -6.217248937900877e-14 | -7.656710514656252e-03 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -4.668028015450052e+00 | -4.796163466380676e-14 | -5.906605254163394e-03 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -4.668028015450057e+00 | -5.329070518200751e-14 | -6.562894726848216e-03 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -4.668028015450063e+00 | -5.950795411990839e-14 | -7.328565778313841e-03 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -4.668028015450066e+00 | -6.217248937900877e-14 | -7.656710514656252e-03 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -4.668028015450066e+00 | -6.217248937900877e-14 | -7.656710514656252e-03 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -4.668028015450085e+00 | -8.171241461241152e-14 | -1.006310524783393e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -4.668028015450066e+00 | -6.217248937900877e-14 | -7.656710514656252e-03 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -4.668028015450103e+00 | -9.947598300641403e-14 | -1.225073682345000e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -4.668028015450094e+00 | -9.059419880941277e-14 | -1.115692103564197e-02 | PASS |