Input 30-stress.05-output_scf.inp
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | 1.129672570000000e-03 | 7.884963360000000e-04 | 8.930000000000000e-04 | 3.411762340000000e-04 | PASS |
| Pressure (GPa) | 3.323612672000000e+01 | 2.319837160000000e+01 | 2.630000000000000e+01 | 1.003775512000000e+01 | PASS |
| Stress (xx) | -1.129673191000000e-03 | -7.887080519300001e-04 | 8.930000000000000e-04 | -3.409651390699999e-04 | PASS |
| Stress (yy) | -1.129671502000000e-03 | -7.883179817000000e-04 | 8.930000000000000e-04 | -3.413535203000000e-04 | PASS |
| Stress (zz) | -1.129673030000000e-03 | -7.884629791150000e-04 | 8.930000000000000e-04 | -3.412100508850000e-04 | PASS |
| Stress (xy) | -1.315639993000000e-10 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.942833429992999e-07 | PASS |
| Stress (yx) | -1.315639993000000e-10 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.942833429992999e-07 | PASS |
| Stress (yz) | 1.541640890000000e-10 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.623125256089000e-06 | PASS |
| Stress (zy) | 1.541640891000000e-10 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.623125256089100e-06 | PASS |
| Stress (zx) | 3.538053657000000e-11 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.763455634463430e-06 | PASS |
| Stress (xz) | 3.538053657000000e-11 | 3.763491015000000e-06 | 5.450000000000000e-06 | -3.763455634463430e-06 | PASS |