Input 30-stress.05-output_scf.inp
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Run foss-serial-debug: [foss2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
Pressure (H/b^3) | 1.105210050000000e-03 | 7.884963360000000e-04 | 8.930000000000000e-04 | 3.167137139999999e-04 | PASS |
Pressure (GPa) | 3.251641409000000e+01 | 2.319837160000000e+01 | 2.630000000000000e+01 | 9.318042489999996e+00 | PASS |
Stress (xx) | -1.105363411000000e-03 | -7.887080519300001e-04 | 8.930000000000000e-04 | -3.166553590699999e-04 | PASS |
Stress (yy) | -1.105153778000000e-03 | -7.883179817000000e-04 | 8.930000000000000e-04 | -3.168357962999999e-04 | PASS |
Stress (zz) | -1.105112955000000e-03 | -7.884629791150000e-04 | 8.930000000000000e-04 | -3.166499758850000e-04 | PASS |
Stress (xy) | -6.520508697000000e-07 | 3.941517790000000e-07 | 3.250000000000000e-06 | -1.046202648700000e-06 | PASS |
Stress (yx) | -6.520508697000000e-07 | 3.941517790000000e-07 | 3.250000000000000e-06 | -1.046202648700000e-06 | PASS |
Stress (yz) | -2.751931744000000e-07 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.347777917600000e-06 | PASS |
Stress (zy) | -2.751931744000000e-07 | -4.622971092000000e-06 | 7.430000000000000e-06 | 4.347777917600000e-06 | PASS |
Stress (zx) | -4.483189386000000e-07 | 3.763491015000000e-06 | 5.450000000000000e-06 | -4.211809953600000e-06 | PASS |
Stress (xz) | -4.483189386000000e-07 | 3.763491015000000e-06 | 5.450000000000000e-06 | -4.211809953600000e-06 | PASS |