Input 15-crank_nicolson.04-freeze_states.inp

Commits > Commit f72050fe95608e153e1887ef05d1ad42dc082fde > Run intel-serial: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.022657179873564e+01 -1.022657179873567e+01 1.020000000000000e-13 3.375077994860476e-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 1.953992523340276e-14 PASS
Energy [step 15] -1.012563491015763e+01 -1.012563491015765e+01 1.010000000000000e-13 1.776356839400250e-14 PASS
Energy [step 20] -1.011739812323844e+01 -1.011739812323845e+01 1.010000000000000e-13 7.105427357601002e-15 PASS
Dipole [step 1] 2.820971422765311e-15 -1.039108394869460e-15 5.830000000000000e-15 3.860079817634771e-15 PASS
Dipole [step 5] -3.955586853259874e-01 -3.955586853259905e-01 6.110000000000000e-15 3.108624468950438e-15 PASS
Dipole [step 10] -7.406750729061501e-01 -7.406750729061549e-01 7.410000000000000e-15 4.773959005888173e-15 PASS
Dipole [step 15] -1.039084057464592e+00 -1.039084057464601e+00 1.140000000000000e-14 8.659739592076221e-15 PASS
Dipole [step 20] -1.295829936532781e+00 -1.295829936532780e+00 1.300000000000000e-14 -8.881784197001252e-16 PASS
Compare to other inputs