Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss_valgrind_autotools: [foss2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
N_electrons [step 0] | 2.999999999999999e+00 | 3.000000000000000e+00 | 2.000000000000000e-07 | -1.332267629550188e-15 | PASS |
N_electrons [step 500] | 2.926157572407817e+00 | 2.926157647067783e+00 | 1.820000000000000e-07 | -7.465996620936721e-08 | PASS |
N_electrons [step 1112] | 2.353009910870533e+00 | 2.353010052117660e+00 | 3.500000000000000e-07 | -1.412471268835702e-07 | PASS |
norm11 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 2.220446049250313e-16 | PASS |
norm11 [step 500] | 9.848360404689873e-01 | 9.848360389306172e-01 | 1.300000000000000e-07 | 1.538370097975417e-09 | PASS |
norm11 [step 1112] | 8.637100113290500e-01 | 8.637099847839140e-01 | 3.000000000000000e-07 | 2.654513597821762e-08 | PASS |
norm21 [step 0] | 9.999999999999993e-01 | 1.000000000000000e+00 | 3.000000000000000e-07 | -6.661338147750939e-16 | PASS |
norm21 [step 500] | 9.923827776947137e-01 | 9.923827888392015e-01 | 3.000000000000000e-07 | -1.114448777705945e-08 | PASS |
norm21 [step 1112] | 9.199553006832630e-01 | 9.199554254748805e-01 | 3.000000000000000e-07 | -1.247916174840213e-07 | PASS |