Input 30-stress.05-output_scf.inp
Commits >
Commit 235dfa244e23366de619648bda83df5634b8df23 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | 1.550159040000000e-04 | 7.884963360000000e-04 | 8.930000000000000e-04 | -6.334804320000001e-04 | PASS |
| Pressure (GPa) | 4.560727010000000e+00 | 2.319837160000000e+01 | 2.630000000000000e+01 | -1.863764459000000e+01 | PASS |
| Stress (xx) | -1.577625640000000e-04 | -7.887080519300001e-04 | 8.930000000000000e-04 | 6.309454879300001e-04 | PASS |
| Stress (yy) | -1.520984021000000e-04 | -7.883179817000000e-04 | 8.930000000000000e-04 | 6.362195796000000e-04 | PASS |
| Stress (zz) | -1.551867449000000e-04 | -7.884629791150000e-04 | 8.930000000000000e-04 | 6.332762342149999e-04 | PASS |
| Stress (xy) | 1.842033039000000e-06 | 3.941517790000000e-07 | 3.250000000000000e-06 | 1.447881260000000e-06 | PASS |
| Stress (yx) | 1.842033039000000e-06 | 3.941517790000000e-07 | 3.250000000000000e-06 | 1.447881260000000e-06 | PASS |
| Stress (yz) | -1.057528696000000e-07 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.517218222400000e-06 | PASS |
| Stress (zy) | -1.057528696000000e-07 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.517218222400000e-06 | PASS |
| Stress (zx) | 1.354465117000000e-07 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.628044503300000e-06 | PASS |
| Stress (xz) | 1.354465117000000e-07 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.628044503300000e-06 | PASS |