Input 04-lithium.02-absorbing_boundaries.inp

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Run spack_foss-2022a_valgrind

Matches

Name Value Reference Precision Difference Status
N_electrons [step 0] 3.000000000000001e+00 3.000000000000000e+00 2.000000000000000e-07 1.332267629550188e-15 PASS
N_electrons [step 500] 2.926157554747272e+00 2.926157647067783e+00 1.820000000000000e-07 -9.232051123575502e-08 PASS
N_electrons [step 1112] 2.353009823373599e+00 2.353010052117660e+00 3.500000000000000e-07 -2.287440610260205e-07 PASS
norm11 [step 0] 9.999999999999997e-01 1.000000000000000e+00 1.300000000000000e-07 -3.330669073875470e-16 PASS
norm11 [step 500] 9.848360374955228e-01 9.848360389306172e-01 1.300000000000000e-07 -1.435094376667223e-09 PASS
norm11 [step 1112] 8.637099555995015e-01 8.637099847839140e-01 3.000000000000000e-07 -2.918441255328474e-08 PASS
norm21 [step 0] 1.000000000000001e+00 1.000000000000000e+00 3.000000000000000e-07 6.661338147750939e-16 PASS
norm21 [step 500] 9.923827652787990e-01 9.923827888392015e-01 3.000000000000000e-07 -2.356040251783043e-08 PASS
norm21 [step 1112] 9.199553013842919e-01 9.199554254748805e-01 3.000000000000000e-07 -1.240905885824262e-07 PASS
Compare to other inputs