Input 15-crank_nicolson.03-freeze_domains.inp

Commits > Commit 4eed2c655b9f478fca43a397c5feb863f7436add > Run spack_foss-2022a_mpi_omp

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.022654035874431e+01 -1.022654035874430e+01 5.110000000000000e-13 -7.105427357601002e-15 PASS
Energy [step 5] -1.014064572817561e+01 -1.014064572817560e+01 5.070000000000000e-14 -1.243449787580175e-14 PASS
Energy [step 10] -1.013378662931814e+01 -1.013378662931820e+01 5.070000000000000e-13 5.506706202140776e-14 PASS
Energy [step 15] -1.012560361793023e+01 -1.012560361792900e+01 5.060000000000000e-12 -1.232791646543774e-12 PASS
Energy [step 20] -1.011736675688520e+01 -1.011736675688520e+01 5.060000000000000e-13 1.776356839400250e-15 PASS
Dipole [step 1] -1.998401444325282e-15 -7.216449660063501e-16 3.720000000000000e-15 -1.276756478318932e-15 PASS
Dipole [step 5] -3.955589211257082e-01 -3.955589211257070e-01 1.980000000000000e-14 -1.221245327087672e-15 PASS
Dipole [step 10] -7.406769413990228e-01 -7.406769413990340e-01 3.700000000000000e-14 1.110223024625157e-14 PASS
Dipole [step 15] -1.039087772402139e+00 -1.039087772402140e+00 5.200000000000000e-14 6.661338147750939e-16 PASS
Dipole [step 20] -1.295835165527738e+00 -1.295835165527720e+00 6.480000000000000e-14 -1.754152378907747e-14 PASS
Projections -1.040834085586084e-16 1.179611963664229e-16 3.610000000000000e-14 -2.220446049250313e-16 PASS
Projections 1.000000000000000e+00 1.000000000000000e+00 3.940000000000000e-14 0.000000000000000e+00 PASS
Compare to other inputs