Input 30-stress.05-output_scf.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | 4.183659940000000e-05 | 7.884963360000000e-04 | 8.930000000000000e-04 | -7.466597366000001e-04 | PASS |
| Pressure (GPa) | 1.230875700000000e+00 | 2.319837160000000e+01 | 2.630000000000000e+01 | -2.196749590000000e+01 | PASS |
| Stress (xx) | -4.178357866000000e-05 | -7.887080519300001e-04 | 8.930000000000000e-04 | 7.469244732700001e-04 | PASS |
| Stress (yy) | -4.181853020000000e-05 | -7.883179817000000e-04 | 8.930000000000000e-04 | 7.464994515000000e-04 | PASS |
| Stress (zz) | -4.190768939000000e-05 | -7.884629791150000e-04 | 8.930000000000000e-04 | 7.465552897249999e-04 | PASS |
| Stress (xy) | -2.468864123000000e-09 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.966206431229999e-07 | PASS |
| Stress (yx) | -2.468864123000000e-09 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.966206431229999e-07 | PASS |
| Stress (yz) | -2.161935901000000e-10 | -5.416216727000000e-06 | 6.550000000000000e-06 | 5.416000533409900e-06 | PASS |
| Stress (zy) | -2.161935898000000e-10 | -5.416216727000000e-06 | 6.550000000000000e-06 | 5.416000533410200e-06 | PASS |
| Stress (zx) | -6.298170582000000e-09 | -9.474674102000000e-07 | 1.040000000000000e-06 | 9.411692396180000e-07 | PASS |
| Stress (xz) | -6.298170582000000e-09 | -9.474674102000000e-07 | 1.040000000000000e-06 | 9.411692396180000e-07 | PASS |