Input 15-crank_nicolson.05-freeze_sae.inp
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_omp_autotools: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -5.571938259894006e-01 | -5.571938259894033e-01 | 4.010000000000000e-14 | 2.664535259100376e-15 | PASS |
| Energy [step 5] | -5.157327347418356e-01 | -5.157327347418467e-01 | 2.780000000000000e-14 | 1.110223024625157e-14 | PASS |
| Energy [step 10] | -5.157327347416943e-01 | -5.157327347416979e-01 | 3.030000000000000e-14 | 3.552713678800501e-15 | PASS |
| Energy [step 15] | -5.157327347416570e-01 | -5.157327347416570e-01 | 1.950000000000000e-14 | 0.000000000000000e+00 | PASS |
| Energy [step 20] | -5.157327347416739e-01 | -5.157327347416979e-01 | 4.100000000000000e-14 | 2.398081733190338e-14 | PASS |
| Dipole [step 1] | 7.844115981758825e-17 | -7.379220068245151e-16 | 5.560000000000000e-15 | 8.163631666421034e-16 | PASS |
| Dipole [step 5] | -1.928247888208893e-01 | -1.928247888208892e-01 | 4.590000000000000e-15 | -8.326672684688674e-17 | PASS |
| Dipole [step 10] | -3.545495747886666e-01 | -3.545495747886674e-01 | 4.430000000000000e-15 | 7.771561172376096e-16 | PASS |
| Dipole [step 15] | -4.859689858458460e-01 | -4.859689858458450e-01 | 2.430000000000000e-14 | -9.436895709313831e-16 | PASS |
| Dipole [step 20] | -6.087120870676898e-01 | -6.087120870676892e-01 | 6.960000000000000e-15 | -5.551115123125783e-16 | PASS |