Input 15-crank_nicolson.02-kick.inp
Commits >
Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca >
Run foss-min-parallel-zen4: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -1.058497392618078e+01 | -1.058497392618078e+01 | 1.060000000000000e-13 | -1.776356839400250e-15 | PASS |
| Energy [step 5] | -1.042952410766964e+01 | -1.042952410766969e+01 | 1.040000000000000e-13 | 5.151434834260726e-14 | PASS |
| Energy [step 10] | -1.042951819589648e+01 | -1.042951819589651e+01 | 1.040000000000000e-13 | 3.375077994860476e-14 | PASS |
| Energy [step 15] | -1.042951645116268e+01 | -1.042951645116274e+01 | 1.040000000000000e-13 | 5.861977570020827e-14 | PASS |
| Energy [step 20] | -1.042951647298848e+01 | -1.042951647298858e+01 | 1.130000000000000e-13 | 9.947598300641403e-14 | PASS |
| Dipole [step 1] | -3.108624468950438e-15 | 1.780638116610150e-16 | 6.520000000000000e-15 | -3.286688280611453e-15 | PASS |
| Dipole [step 5] | -7.295369687089863e-01 | -7.295369687093400e-01 | 3.930000000000000e-13 | 3.537170556455749e-13 | PASS |
| Dipole [step 10] | -1.339262978999554e+00 | -1.339262979000332e+00 | 8.650000000000001e-13 | 7.776002064474596e-13 | PASS |
| Dipole [step 15] | -1.833828239415431e+00 | -1.833828239416189e+00 | 8.390000000000000e-13 | 7.578382366091319e-13 | PASS |
| Dipole [step 20] | -2.215299445825477e+00 | -2.215299445825728e+00 | 2.800000000000000e-13 | 2.509104035652854e-13 | PASS |