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] |
2.319032787701281e+00 |
2.319032630881478e+00 |
3.060000000000000e-07 |
1.568198033652379e-07 |
PASS |
norm11 [step 0] |
9.999999999999999e-01 |
1.000000000000000e+00 |
1.300000000000000e-07 |
-1.110223024625157e-16 |
PASS |
norm11 [step 500] |
8.562173152132762e-01 |
8.562172473301963e-01 |
7.470000000000000e-08 |
6.788307982397157e-08 |
PASS |
norm21 [step 0] |
1.000000000000000e+00 |
1.000000000000000e+00 |
1.300000000000000e-07 |
2.220446049250313e-16 |
PASS |
norm21 [step 500] |
9.153054822929944e-01 |
9.153054729587488e-01 |
2.520000000000000e-08 |
9.334245598680013e-09 |
PASS |