Input 30-stress.05-output_scf.inp
Commits >
Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca >
Run intel-parallel-debug: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | 1.128774700000000e-03 | 7.884963360000000e-04 | 8.930000000000000e-04 | 3.402783639999999e-04 | PASS |
| Pressure (GPa) | 3.320971041000000e+01 | 2.319837160000000e+01 | 2.630000000000000e+01 | 1.001133881000000e+01 | PASS |
| Stress (xx) | -1.128775757000000e-03 | -7.887080519300001e-04 | 8.930000000000000e-04 | -3.400677050700000e-04 | PASS |
| Stress (yy) | -1.128762731000000e-03 | -7.883179817000000e-04 | 8.930000000000000e-04 | -3.404447493000001e-04 | PASS |
| Stress (zz) | -1.128785619000000e-03 | -7.884629791150000e-04 | 8.930000000000000e-04 | -3.403226398849999e-04 | PASS |
| Stress (xy) | -1.840552465000000e-09 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.959923314649999e-07 | PASS |
| Stress (yx) | -1.840552465000000e-09 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.959923314649999e-07 | PASS |
| Stress (yz) | 1.762872306000000e-10 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.623147379230600e-06 | PASS |
| Stress (zy) | 1.762872306000000e-10 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.623147379230600e-06 | PASS |
| Stress (zx) | 2.710808911000000e-09 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.760780206089000e-06 | PASS |
| Stress (xz) | 2.710808911000000e-09 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.760780206089000e-06 | PASS |