Input 15-crank_nicolson.03-freeze_domains.inp

Commits > Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 > Run cuda-mpi-omp: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.022657179873566e+01 -1.022657179873567e+01 1.020000000000000e-13 1.065814103640150e-14 PASS
Energy [step 5] -1.014067705119930e+01 -1.014067705119932e+01 1.010000000000000e-13 1.953992523340276e-14 PASS
Energy [step 10] -1.013381790798761e+01 -1.013381790798763e+01 1.010000000000000e-13 1.598721155460225e-14 PASS
Energy [step 15] -1.012563491015762e+01 -1.012563491015765e+01 1.010000000000000e-13 2.842170943040401e-14 PASS
Energy [step 20] -1.011739812323843e+01 -1.011739812323845e+01 1.010000000000000e-13 1.598721155460225e-14 PASS
Dipole [step 1] -7.993605777301127e-15 -7.216449660063501e-16 8.000000000000001e-15 -7.271960811294777e-15 PASS
Dipole [step 5] -3.955586853259980e-01 -3.955586853259932e-01 1.220000000000000e-14 -4.829470157119431e-15 PASS
Dipole [step 10] -7.406750729061624e-01 -7.406750729061549e-01 7.410000000000000e-15 -7.549516567451064e-15 FAIL
Dipole [step 15] -1.039084057464614e+00 -1.039084057464610e+00 1.940000000000000e-14 -4.218847493575595e-15 PASS
Dipole [step 20] -1.295829936532789e+00 -1.295829936532780e+00 1.490000000000000e-14 -9.547918011776346e-15 PASS
Projections -1.387778780781446e-17 1.179611963664229e-16 3.610000000000000e-14 -1.318389841742373e-16 PASS
Projections 1.000000000000000e+00 1.000000000000000e+00 3.940000000000000e-14 4.440892098500626e-16 PASS
Compare to other inputs