Input 15-crank_nicolson.04-freeze_states.inp

Commits > Commit 1bf2bc61d0085049d6bd7294e2825d85d95584e0 > Run foss-cmake-zen4: [foss2023a-serial, foss-min]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.022657179873565e+01 -1.022657179873567e+01 1.020000000000000e-13 1.598721155460225e-14 PASS
Energy [step 5] -1.014067705119930e+01 -1.014067705119932e+01 1.010000000000000e-13 2.486899575160351e-14 PASS
Energy [step 10] -1.013381790798761e+01 -1.013381790798763e+01 1.010000000000000e-13 2.486899575160351e-14 PASS
Energy [step 15] -1.012563491015762e+01 -1.012563491015765e+01 1.010000000000000e-13 3.019806626980426e-14 PASS
Energy [step 20] -1.011739812323843e+01 -1.011739812323845e+01 1.010000000000000e-13 1.953992523340276e-14 PASS
Dipole [step 1] -4.155035019661694e-15 -1.039108394869460e-15 5.830000000000000e-15 -3.115926624792234e-15 PASS
Dipole [step 5] -3.955586853259938e-01 -3.955586853259905e-01 6.110000000000000e-15 -3.330669073875470e-15 PASS
Dipole [step 10] -7.406750729061561e-01 -7.406750729061549e-01 7.410000000000000e-15 -1.221245327087672e-15 PASS
Dipole [step 15] -1.039084057464598e+00 -1.039084057464601e+00 1.140000000000000e-14 2.886579864025407e-15 PASS
Dipole [step 20] -1.295829936532784e+00 -1.295829936532780e+00 1.300000000000000e-14 -4.218847493575595e-15 PASS
Compare to other inputs