Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| N_electrons [step 0] | 3.000000000000000e+00 | 3.000000000000000e+00 | 2.000000000000000e-07 | 0.000000000000000e+00 | PASS |
| N_electrons [step 500] | 2.319032783228810e+00 | 2.319032666539140e+00 | 3.060000000000000e-07 | 1.166896699267284e-07 | PASS |
| norm11 [step 0] | 9.999999999999997e-01 | 1.000000000000000e+00 | 1.300000000000000e-07 | -3.330669073875470e-16 | PASS |
| norm11 [step 500] | 8.562172925478915e-01 | 8.562172618493429e-01 | 7.410000000000000e-08 | 3.069854859205634e-08 | PASS |
| norm21 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 2.220446049250313e-16 | PASS |
| norm21 [step 500] | 9.153054666610159e-01 | 9.153054751738938e-01 | 1.820000000000000e-08 | -8.512877958111176e-09 | PASS |