Input 15-crank_nicolson.02-kick.inp
Commits >
Commit ab5faecb27d88076e64ba8608dc3fc5641398a04 >
Run intel_omp_autotools: [intel2022a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -1.058497392618079e+01 | -1.058497392618078e+01 | 1.060000000000000e-13 | -1.243449787580175e-14 | PASS |
| Energy [step 5] | -1.042952410766974e+01 | -1.042952410766969e+01 | 1.040000000000000e-13 | -4.796163466380676e-14 | PASS |
| Energy [step 10] | -1.042951819589654e+01 | -1.042951819589651e+01 | 1.040000000000000e-13 | -2.842170943040401e-14 | PASS |
| Energy [step 15] | -1.042951645116279e+01 | -1.042951645116274e+01 | 1.040000000000000e-13 | -5.329070518200751e-14 | PASS |
| Energy [step 20] | -1.042951647298864e+01 | -1.042951647298858e+01 | 1.130000000000000e-13 | -6.394884621840902e-14 | PASS |
| Dipole [step 1] | 3.187422981804078e-15 | 1.780638116610150e-16 | 6.520000000000000e-15 | 3.009359170143063e-15 | PASS |
| Dipole [step 5] | -7.295369687096869e-01 | -7.295369687093400e-01 | 3.930000000000000e-13 | -3.468336728928989e-13 | PASS |
| Dipole [step 10] | -1.339262979001101e+00 | -1.339262979000332e+00 | 8.650000000000001e-13 | -7.689404668553834e-13 | PASS |
| Dipole [step 15] | -1.833828239416936e+00 | -1.833828239416189e+00 | 8.390000000000000e-13 | -7.469580509678053e-13 | PASS |
| Dipole [step 20] | -2.215299445825961e+00 | -2.215299445825728e+00 | 2.800000000000000e-13 | -2.327027459614328e-13 | PASS |