Match comparison for Force C1 (z) (match type 29548)
Commits >
Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca >
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 | -9.261778173684211e-16 | 6.998863755299892e-16 | -5.223815424999999e-16 | 1.195942127500000e-15 | 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-serial-zen4: [foss2023a-serial] | -3.078454590000000e-16 | 1.603603861000000e-15 | 3.595524352017938e-01 | PASS |
| intel-serial: [intel2023a-serial] | 6.735605850000000e-16 | 2.585009905000000e-15 | 5.795986334080718e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -1.649544370000000e-15 | 2.619049500000001e-16 | 5.872308295964127e-02 | PASS |
| intel-parallel: [intel2023a-mpi] | -1.718323670000000e-15 | 1.931256500000000e-16 | 4.330171524663678e-02 | PASS |
| foss-parallel-zen4: [foss2023a-mpi] | -1.215580410000000e-15 | 6.958689100000000e-16 | 1.560244192825112e-01 | PASS |
| foss-min-parallel-zen4: [foss2023a-mpi] | -1.215580410000000e-15 | 6.958689100000000e-16 | 1.560244192825112e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -1.231622870000000e-15 | 6.798264500000001e-16 | 1.524274551569507e-01 | PASS |
| foss-serial: [foss2023a-serial] | -2.201948780000000e-16 | 1.691254442000000e-15 | 3.792050318385650e-01 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -1.231622870000000e-15 | 6.798264500000001e-16 | 1.524274551569507e-01 | PASS |
| ppc: [foss2023a-serial] | -1.050331910000000e-15 | 8.611174100000001e-16 | 1.930756524663678e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -1.349283360000000e-15 | 5.621659600000000e-16 | 1.260461793721973e-01 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -7.718989750000000e-16 | 1.139550345000000e-15 | 2.555045616591928e-01 | PASS |
| intel-serial-debug: [intel2023a-serial] | 6.735605850000000e-16 | 2.585009905000000e-15 | 5.795986334080718e-01 | PASS |
| foss-parallel: [foss2023a-mpi] | -1.231622870000000e-15 | 6.798264500000001e-16 | 1.524274551569507e-01 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -1.231622870000000e-15 | 6.798264500000001e-16 | 1.524274551569507e-01 | PASS |
| intel-parallel-debug: [intel2023a-mpi] | -1.718323670000000e-15 | 1.931256500000000e-16 | 4.330171524663678e-02 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -1.349283360000000e-15 | 5.621659600000000e-16 | 1.260461793721973e-01 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -1.231622870000000e-15 | 6.798264500000001e-16 | 1.524274551569507e-01 | PASS |