Input 04-lithium.02-absorbing_boundaries.inp
Matches
Name |
Value |
Reference |
Precision |
Difference |
Status |
N_electrons [step 0] |
3.000000000000000e+00 |
3.000000000000000e+00 |
2.000000000000000e-07 |
4.440892098500626e-16 |
PASS |
N_electrons [step 500] |
2.926157577308875e+00 |
2.926157647067783e+00 |
1.820000000000000e-07 |
-6.975890798344153e-08 |
PASS |
N_electrons [step 1112] |
2.353009931619138e+00 |
2.353010052117660e+00 |
3.500000000000000e-07 |
-1.204985213831833e-07 |
PASS |
norm11 [step 0] |
1.000000000000000e+00 |
1.000000000000000e+00 |
1.300000000000000e-07 |
2.220446049250313e-16 |
PASS |
norm11 [step 500] |
9.848360341290865e-01 |
9.848360389306172e-01 |
1.300000000000000e-07 |
-4.801530728570924e-09 |
PASS |
norm11 [step 1112] |
8.637099829253927e-01 |
8.637099847839140e-01 |
3.000000000000000e-07 |
-1.858521336828289e-09 |
PASS |
norm21 [step 0] |
1.000000000000001e+00 |
1.000000000000000e+00 |
3.000000000000000e-07 |
8.881784197001252e-16 |
PASS |
norm21 [step 500] |
9.923827649479543e-01 |
9.923827888392015e-01 |
3.000000000000000e-07 |
-2.389124720281188e-08 |
PASS |
norm21 [step 1112] |
9.199553344418210e-01 |
9.199554254748805e-01 |
3.000000000000000e-07 |
-9.103305953495067e-08 |
PASS |