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 |
0.000000000000000e+00 |
PASS |
N_electrons [step 500] |
2.926157727854170e+00 |
2.926157647067783e+00 |
1.820000000000000e-07 |
8.078638646935588e-08 |
PASS |
N_electrons [step 1112] |
2.353009917447201e+00 |
2.353010052117660e+00 |
3.500000000000000e-07 |
-1.346704587845693e-07 |
PASS |
norm11 [step 0] |
1.000000000000000e+00 |
1.000000000000000e+00 |
1.300000000000000e-07 |
2.220446049250313e-16 |
PASS |
norm11 [step 500] |
9.848360938834517e-01 |
9.848360389306172e-01 |
1.300000000000000e-07 |
5.495283450507316e-08 |
PASS |
norm11 [step 1112] |
8.637099564825368e-01 |
8.637099847839140e-01 |
3.000000000000000e-07 |
-2.830137724174620e-08 |
PASS |
norm21 [step 0] |
1.000000000000000e+00 |
1.000000000000000e+00 |
3.000000000000000e-07 |
2.220446049250313e-16 |
PASS |
norm21 [step 500] |
9.923827672581956e-01 |
9.923827888392015e-01 |
3.000000000000000e-07 |
-2.158100587124068e-08 |
PASS |
norm21 [step 1112] |
9.199553353949804e-01 |
9.199554254748805e-01 |
3.000000000000000e-07 |
-9.007990009468614e-08 |
PASS |