Input 15-crank_nicolson.03-freeze_domains.inp
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run intel_mpi_autotools: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -1.022657179873566e+01 | -1.022657179873567e+01 | 1.020000000000000e-13 | 5.329070518200751e-15 | PASS |
| Energy [step 5] | -1.014067705119931e+01 | -1.014067705119932e+01 | 1.010000000000000e-13 | 8.881784197001252e-15 | PASS |
| Energy [step 10] | -1.013381790798763e+01 | -1.013381790798763e+01 | 1.010000000000000e-13 | 3.552713678800501e-15 | PASS |
| Energy [step 15] | -1.012563491015763e+01 | -1.012563491015765e+01 | 1.010000000000000e-13 | 1.953992523340276e-14 | PASS |
| Energy [step 20] | -1.011739812323844e+01 | -1.011739812323845e+01 | 1.010000000000000e-13 | 5.329070518200751e-15 | PASS |
| Dipole [step 1] | -6.238065619612598e-15 | -7.216449660063501e-16 | 8.000000000000001e-15 | -5.516420653606248e-15 | PASS |
| Dipole [step 5] | -3.955586853260005e-01 | -3.955586853259912e-01 | 1.010000000000000e-14 | -9.270362255620057e-15 | PASS |
| Dipole [step 10] | -7.406750729061617e-01 | -7.406750729061549e-01 | 7.410000000000000e-15 | -6.883382752675971e-15 | PASS |
| Dipole [step 15] | -1.039084057464628e+00 | -1.039084057464610e+00 | 1.940000000000000e-14 | -1.754152378907747e-14 | PASS |
| Dipole [step 20] | -1.295829936532779e+00 | -1.295829936532780e+00 | 1.490000000000000e-14 | 4.440892098500626e-16 | PASS |
| Projections | 3.111660235033398e-17 | 1.179611963664229e-16 | 3.610000000000000e-14 | -8.684459401608891e-17 | PASS |
| Projections | 1.000000000000000e+00 | 1.000000000000000e+00 | 3.940000000000000e-14 | 2.220446049250313e-16 | PASS |