Input 04-lithium.02-absorbing_boundaries.inp

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Run spack_intel-2023a_impi

Matches

Name Value Reference Precision Difference Status
N_electrons [step 0] 2.999999999999995e+00 3.000000000000000e+00 2.000000000000000e-07 -5.329070518200751e-15 PASS
N_electrons [step 500] 2.926157469014540e+00 2.926157647067783e+00 1.820000000000000e-07 -1.780532428163895e-07 PASS
N_electrons [step 1112] 2.353009817044177e+00 2.353010052117660e+00 3.500000000000000e-07 -2.350734829015266e-07 PASS
norm11 [step 0] 9.999999999999993e-01 1.000000000000000e+00 1.300000000000000e-07 -6.661338147750939e-16 PASS
norm11 [step 500] 9.848360310432975e-01 9.848360389306172e-01 1.300000000000000e-07 -7.887319686261662e-09 PASS
norm11 [step 1112] 8.637099807419412e-01 8.637099847839140e-01 3.000000000000000e-07 -4.041972867518950e-09 PASS
norm21 [step 0] 9.999999999999981e-01 1.000000000000000e+00 3.000000000000000e-07 -1.887379141862766e-15 PASS
norm21 [step 500] 9.923827325335562e-01 9.923827888392015e-01 3.000000000000000e-07 -5.630564525738180e-08 PASS
norm21 [step 1112] 9.199552720508224e-01 9.199554254748805e-01 3.000000000000000e-07 -1.534240581246848e-07 PASS
Compare to other inputs