Match comparison for Force C1 (z) (match type 29548)
Commits >
Commit 98d0ca144537205e7b2aa0b44074de55ddb8c97d >
Input 12-vdw_solid_c6.02-gs_graphene.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.911449320000000e-15 | 4.460000000000000e-15 | -4.813808197647059e-16 | 4.496969903112558e-16 | -8.260325930000000e-16 | 6.404640770000001e-16 | PASS |
Checks for this match
- Precision seems large and value close to zero. Should value be 0?
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.00000000000000191144932, precision: 0.00000000000000446| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -2.985359720000000e-16 | 1.612913348000000e-15 | 3.616397641255605e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -4.954847760000000e-16 | 1.415964544000000e-15 | 3.174808394618834e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -3.078454590000000e-16 | 1.603603861000000e-15 | 3.595524352017938e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -3.663634810000000e-16 | 1.545085839000000e-15 | 3.464318024663677e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -1.466496670000000e-15 | 4.449526500000000e-16 | 9.976516816143498e-02 | PASS |
| intel_autotools: [intel2023a-serial] | -4.912244690000000e-16 | 1.420224851000000e-15 | 3.184360652466368e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -9.461209950000001e-16 | 9.653283250000000e-16 | 2.164413284753363e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.256171440000000e-15 | 6.552778800000001e-16 | 1.469232914798206e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -1.231622870000000e-15 | 6.798264500000001e-16 | 1.524274551569507e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.378299590000000e-15 | 5.331497300000000e-16 | 1.195402982062780e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -1.367522200000000e-15 | 5.439271200000001e-16 | 1.219567533632287e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.975281500000000e-16 | 1.713921170000000e-15 | 3.842872578475336e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -1.855685160000000e-16 | 1.725880804000000e-15 | 3.869687901345292e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.129348710000000e-15 | 7.821006100000001e-16 | 1.753588811659193e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -1.376749150000000e-15 | 5.347001700000000e-16 | 1.198879304932735e-01 | PASS |