Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| N_electrons [step 0] | 3.000000000000001e+00 | 3.000000000000000e+00 | 2.000000000000000e-07 | 8.881784197001252e-16 | PASS |
| N_electrons [step 500] | 2.319032796071777e+00 | 2.319032666539140e+00 | 3.060000000000000e-07 | 1.295326375050365e-07 | PASS |
| norm11 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 0.000000000000000e+00 | PASS |
| norm11 [step 500] | 8.562173292556394e-01 | 8.562172618493429e-01 | 7.410000000000000e-08 | 6.740629654444774e-08 | PASS |
| norm21 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 2.220446049250313e-16 | PASS |
| norm21 [step 500] | 9.153054767614993e-01 | 9.153054751738938e-01 | 1.820000000000000e-08 | 1.587605491515376e-09 | PASS |