Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_mpi_omp_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| N_electrons [step 0] | 2.999999999999998e+00 | 3.000000000000000e+00 | 2.000000000000000e-07 | -1.776356839400250e-15 | PASS |
| N_electrons [step 500] | 2.319032904063763e+00 | 2.319032666539140e+00 | 3.060000000000000e-07 | 2.375246235253314e-07 | PASS |
| norm11 [step 0] | 9.999999999999998e-01 | 1.000000000000000e+00 | 1.300000000000000e-07 | -2.220446049250313e-16 | PASS |
| norm11 [step 500] | 8.562172023520669e-01 | 8.562172618493429e-01 | 7.410000000000000e-08 | -5.949727599485755e-08 | PASS |
| norm21 [step 0] | 9.999999999999997e-01 | 1.000000000000000e+00 | 1.300000000000000e-07 | -3.330669073875470e-16 | PASS |
| norm21 [step 500] | 9.153054722212921e-01 | 9.153054751738938e-01 | 1.820000000000000e-08 | -2.952601718675396e-09 | PASS |