Input 15-crank_nicolson.03-freeze_domains.inp
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_mpi_omp_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -1.022657179873567e+01 | -1.022657179873567e+01 | 1.020000000000000e-13 | 3.552713678800501e-15 | PASS |
| Energy [step 5] | -1.014067705119930e+01 | -1.014067705119932e+01 | 1.010000000000000e-13 | 1.776356839400250e-14 | PASS |
| Energy [step 10] | -1.013381790798762e+01 | -1.013381790798763e+01 | 1.010000000000000e-13 | 1.421085471520200e-14 | PASS |
| Energy [step 15] | -1.012563491015762e+01 | -1.012563491015765e+01 | 1.010000000000000e-13 | 2.664535259100376e-14 | PASS |
| Energy [step 20] | -1.011739812323844e+01 | -1.011739812323845e+01 | 1.010000000000000e-13 | 1.421085471520200e-14 | PASS |
| Dipole [step 1] | -1.776356839400250e-15 | -7.216449660063501e-16 | 8.000000000000001e-15 | -1.054711873393900e-15 | PASS |
| Dipole [step 5] | -3.955586853259874e-01 | -3.955586853259932e-01 | 9.279999999999999e-15 | 5.828670879282072e-15 | PASS |
| Dipole [step 10] | -7.406750729061553e-01 | -7.406750729061549e-01 | 7.410000000000000e-15 | -4.440892098500626e-16 | PASS |
| Dipole [step 15] | -1.039084057464609e+00 | -1.039084057464608e+00 | 1.940000000000000e-14 | -8.881784197001252e-16 | PASS |
| Dipole [step 20] | -1.295829936532786e+00 | -1.295829936532780e+00 | 1.490000000000000e-14 | -5.995204332975845e-15 | PASS |
| Projections | -4.510281037539698e-17 | 1.179611963664229e-16 | 3.610000000000000e-14 | -1.630640067418199e-16 | PASS |
| Projections | 9.999999999999996e-01 | 1.000000000000000e+00 | 3.940000000000000e-14 | -4.440892098500626e-16 | PASS |