Input 30-stress.05-output_scf.inp
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | 1.131913030000000e-03 | 7.884963360000000e-04 | 8.930000000000000e-04 | 3.434166939999999e-04 | PASS |
| Pressure (GPa) | 3.330204312000000e+01 | 2.319837160000000e+01 | 2.630000000000000e+01 | 1.010367152000000e+01 | PASS |
| Stress (xx) | -1.131917880000000e-03 | -7.887080519300001e-04 | 8.930000000000000e-04 | -3.432098280700000e-04 | PASS |
| Stress (yy) | -1.131918537000000e-03 | -7.883179817000000e-04 | 8.930000000000000e-04 | -3.436005553000000e-04 | PASS |
| Stress (zz) | -1.131902660000000e-03 | -7.884629791150000e-04 | 8.930000000000000e-04 | -3.434396808849999e-04 | PASS |
| Stress (xy) | 4.047959009000000e-09 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.901038199910000e-07 | PASS |
| Stress (yx) | 4.047959009000000e-09 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.901038199910000e-07 | PASS |
| Stress (yz) | 3.373512684000000e-09 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.626344604684000e-06 | PASS |
| Stress (zy) | 3.373512685000000e-09 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.626344604685000e-06 | PASS |
| Stress (zx) | -1.601374197000000e-09 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.765092389197000e-06 | PASS |
| Stress (xz) | -1.601374197000000e-09 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.765092389197000e-06 | PASS |