Input 30-stress.05-output_scf.inp
Commits >
Commit 6fea4ae0129736a1dfe4fc8183ca68b9f7403b45 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | -1.929949360000000e-05 | 7.884963360000000e-04 | 8.930000000000000e-04 | -8.077958296000001e-04 | PASS |
| Pressure (GPa) | -5.678109099999999e-01 | 2.319837160000000e+01 | 2.630000000000000e+01 | -2.376618251000000e+01 | PASS |
| Stress (xx) | 1.932999070000000e-05 | -7.887080519300001e-04 | 8.930000000000000e-04 | 8.080380426300001e-04 | PASS |
| Stress (yy) | 1.930206519000000e-05 | -7.883179817000000e-04 | 8.930000000000000e-04 | 8.076200468900000e-04 | PASS |
| Stress (zz) | 1.926642500000000e-05 | -7.884629791150000e-04 | 8.930000000000000e-04 | 8.077294041150000e-04 | PASS |
| Stress (xy) | 5.095332366000000e-08 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.431984553399999e-07 | PASS |
| Stress (yx) | 5.095332366000000e-08 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.431984553399999e-07 | PASS |
| Stress (yz) | 2.635303903000000e-09 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.625606395903000e-06 | PASS |
| Stress (zy) | 2.635303904000000e-09 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.625606395904000e-06 | PASS |
| Stress (zx) | 5.335306758000000e-08 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.710137947420000e-06 | PASS |
| Stress (xz) | 5.335306758000000e-08 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.710137947420000e-06 | PASS |