Input 04-lithium.02-absorbing_boundaries.inp
Matches
| Name |
Value |
Reference |
Precision |
Difference |
Status |
| N_electrons [step 0] |
2.999999999999995e+00 |
3.000000000000000e+00 |
2.000000000000000e-07 |
-5.329070518200751e-15 |
PASS |
| N_electrons [step 500] |
2.926157469014540e+00 |
2.926157647067783e+00 |
1.820000000000000e-07 |
-1.780532428163895e-07 |
PASS |
| N_electrons [step 1112] |
2.353009817044177e+00 |
2.353010052117660e+00 |
3.060000000000000e-07 |
-2.350734829015266e-07 |
PASS |
| norm11 [step 0] |
9.999999999999993e-01 |
1.000000000000000e+00 |
1.300000000000000e-07 |
-6.661338147750939e-16 |
PASS |
| norm11 [step 500] |
9.848360310432975e-01 |
9.848360389306172e-01 |
1.300000000000000e-07 |
-7.887319686261662e-09 |
PASS |
| norm11 [step 1112] |
8.637099807419412e-01 |
8.637099847839140e-01 |
1.300000000000000e-07 |
-4.041972867518950e-09 |
PASS |
| norm21 [step 0] |
9.999999999999981e-01 |
1.000000000000000e+00 |
1.300000000000000e-07 |
-1.887379141862766e-15 |
PASS |
| norm21 [step 500] |
9.923827325335562e-01 |
9.923827888392015e-01 |
1.300000000000000e-07 |
-5.630564525738180e-08 |
PASS |
| norm21 [step 1112] |
9.199552720508224e-01 |
9.199554254748805e-01 |
3.000000000000000e-07 |
-1.534240581246848e-07 |
PASS |