Input 04-lithium.02-absorbing_boundaries.inp

Commits > Commit abc749737cc12a5b79d975879ed425be2e62065f > Run intel-2022a_omp_impi

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] 2.926157672680656e+00 2.926157647067783e+00 1.820000000000000e-07 2.561287315572258e-08 PASS
N_electrons [step 1112] 2.353010019336502e+00 2.353010052117660e+00 3.060000000000000e-07 -3.278115778826418e-08 PASS
norm11 [step 0] 9.999999999999999e-01 1.000000000000000e+00 1.300000000000000e-07 -1.110223024625157e-16 PASS
norm11 [step 500] 9.848360444436257e-01 9.848360389306172e-01 1.300000000000000e-07 5.513008494162364e-09 PASS
norm11 [step 1112] 8.637099926830316e-01 8.637099847839140e-01 1.300000000000000e-07 7.899117582255144e-09 PASS
norm21 [step 0] 9.999999999999997e-01 1.000000000000000e+00 1.300000000000000e-07 -3.330669073875470e-16 PASS
norm21 [step 500] 9.923827897207317e-01 9.923827888392015e-01 1.300000000000000e-07 8.815301821840649e-10 PASS
norm21 [step 1112] 9.199553637659158e-01 9.199554254748805e-01 3.000000000000000e-07 -6.170896471591192e-08 PASS
Compare to other inputs