Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| N_electrons [step 0] | 3.000000000000002e+00 | 3.000000000000000e+00 | 2.000000000000000e-07 | 1.776356839400250e-15 | PASS |
| N_electrons [step 500] | 2.319032476383351e+00 | 2.319032666539140e+00 | 3.060000000000000e-07 | -1.901557884487204e-07 | PASS |
| norm11 [step 0] | 1.000000000000001e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 6.661338147750939e-16 | PASS |
| norm11 [step 500] | 8.562172155387394e-01 | 8.562172618493429e-01 | 7.410000000000000e-08 | -4.631060346316218e-08 | PASS |
| norm21 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 2.220446049250313e-16 | PASS |
| norm21 [step 500] | 9.153054757265202e-01 | 9.153054751738938e-01 | 1.820000000000000e-08 | 5.526263890942573e-10 | PASS |