Input 30-stress.05-output_scf.inp
Commits >
Commit 235dfa244e23366de619648bda83df5634b8df23 >
Run foss_cmake: [foss2022a-mpi, foss-min-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | 1.126266700000000e-03 | 7.884963360000000e-04 | 8.930000000000000e-04 | 3.377703639999999e-04 | PASS |
| Pressure (GPa) | 3.313592243000000e+01 | 2.319837160000000e+01 | 2.630000000000000e+01 | 9.937550829999999e+00 | PASS |
| Stress (xx) | -1.126276613000000e-03 | -7.887080519300001e-04 | 8.930000000000000e-04 | -3.375685610699999e-04 | PASS |
| Stress (yy) | -1.126233946000000e-03 | -7.883179817000000e-04 | 8.930000000000000e-04 | -3.379159643000000e-04 | PASS |
| Stress (zz) | -1.126289544000000e-03 | -7.884629791150000e-04 | 8.930000000000000e-04 | -3.378265648849999e-04 | PASS |
| Stress (xy) | -2.483446745000000e-08 | 3.941517790000000e-07 | 3.250000000000000e-06 | -4.189862464500000e-07 | PASS |
| Stress (yx) | -2.483446745000000e-08 | 3.941517790000000e-07 | 3.250000000000000e-06 | -4.189862464500000e-07 | PASS |
| Stress (yz) | -3.125397300000000e-08 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.591717119000000e-06 | PASS |
| Stress (zy) | -3.125397300000000e-08 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.591717119000000e-06 | PASS |
| Stress (zx) | -6.422178019000000e-09 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.769913193019000e-06 | PASS |
| Stress (xz) | -6.422178019000000e-09 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.769913193019000e-06 | PASS |