Input 04-lithium.02-absorbing_boundaries.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run intel-2022a_omp

Matches

Name Value Reference Precision Difference Status
N_electrons [step 0] 2.999999999999999e+00 3.000000000000000e+00 2.000000000000000e-07 -8.881784197001252e-16 PASS
N_electrons [step 500] 2.926157651138054e+00 2.926157647067783e+00 1.820000000000000e-07 4.070271231171319e-09 PASS
N_electrons [step 1112] 2.353009821052917e+00 2.353010052117660e+00 3.060000000000000e-07 -2.310647428949153e-07 PASS
norm11 [step 0] 9.999999999999998e-01 1.000000000000000e+00 1.300000000000000e-07 -2.220446049250313e-16 PASS
norm11 [step 500] 9.848360857962263e-01 9.848360389306172e-01 1.300000000000000e-07 4.686560906019821e-08 PASS
norm11 [step 1112] 8.637099111527129e-01 8.637099847839140e-01 1.300000000000000e-07 -7.363120113623722e-08 PASS
norm21 [step 0] 9.999999999999999e-01 1.000000000000000e+00 1.300000000000000e-07 -1.110223024625157e-16 PASS
norm21 [step 500] 9.923827606126419e-01 9.923827888392015e-01 1.300000000000000e-07 -2.822655964518361e-08 PASS
norm21 [step 1112] 9.199553429415934e-01 9.199554254748805e-01 3.000000000000000e-07 -8.253328709351138e-08 PASS
Compare to other inputs