Input 15-crank_nicolson.04-freeze_states.inp

Commits > Commit 9bb80dbc43fc7b1ccbcadf899a686fb8cb0164a9 > Run intel-2022a_omp_impi

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.022654035874431e+01 -1.022654035874430e+01 5.110000000000000e-13 -1.421085471520200e-14 PASS
Energy [step 5] -1.014064572817563e+01 -1.014064572817560e+01 5.070000000000000e-14 -2.842170943040401e-14 PASS
Energy [step 10] -1.013378662931815e+01 -1.013378662931820e+01 5.070000000000000e-13 4.973799150320701e-14 PASS
Energy [step 15] -1.012560361793024e+01 -1.012560361792900e+01 5.060000000000000e-12 -1.238120717061975e-12 PASS
Energy [step 20] -1.011736675688521e+01 -1.011736675688520e+01 5.060000000000000e-13 -5.329070518200751e-15 PASS
Dipole [step 1] -3.608224830031759e-15 -1.039108394869460e-15 3.830000000000000e-15 -2.569116435162299e-15 PASS
Dipole [step 5] -3.955589211257127e-01 -3.955589211257070e-01 1.980000000000000e-14 -5.662137425588298e-15 PASS
Dipole [step 10] -7.406769413990250e-01 -7.406769413990340e-01 3.700000000000000e-14 8.992806499463768e-15 PASS
Dipole [step 15] -1.039087772402139e+00 -1.039087772402140e+00 5.200000000000000e-14 8.881784197001252e-16 PASS
Dipole [step 20] -1.295835165527735e+00 -1.295835165527720e+00 6.480000000000000e-14 -1.532107773982716e-14 PASS
Compare to other inputs