Input 30-stress.05-output_scf.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Pressure (H/b^3) | 2.686261340000000e-04 | 7.884963360000000e-04 | 8.930000000000000e-04 | -5.198702020000000e-04 | PASS |
| Pressure (GPa) | 7.903256620000000e+00 | 2.319837160000000e+01 | 2.630000000000000e+01 | -1.529511498000000e+01 | PASS |
| Stress (xx) | -2.685589747000000e-04 | -7.887080519300001e-04 | 8.930000000000000e-04 | 5.201490772300001e-04 | PASS |
| Stress (yy) | -2.686452793000000e-04 | -7.883179817000000e-04 | 8.930000000000000e-04 | 5.196727024000000e-04 | PASS |
| Stress (zz) | -2.686741493000000e-04 | -7.884629791150000e-04 | 8.930000000000000e-04 | 5.197888298150000e-04 | PASS |
| Stress (xy) | -4.743978340000000e-10 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.946261768339999e-07 | PASS |
| Stress (yx) | -4.743978340000000e-10 | 3.941517790000000e-07 | 3.250000000000000e-06 | -3.946261768339999e-07 | PASS |
| Stress (yz) | -2.732010007000000e-10 | -5.416216727000000e-06 | 6.550000000000000e-06 | 5.415943525999300e-06 | PASS |
| Stress (zy) | -2.732010007000000e-10 | -5.416216727000000e-06 | 6.550000000000000e-06 | 5.415943525999300e-06 | PASS |
| Stress (zx) | -2.834843502000000e-09 | -9.474674102000000e-07 | 1.040000000000000e-06 | 9.446325666980000e-07 | PASS |
| Stress (xz) | -2.834843502000000e-09 | -9.474674102000000e-07 | 1.040000000000000e-06 | 9.446325666980000e-07 | PASS |