Input 06-caetrs.03-kick-tp1.inp
Commits >
Commit e0f0cf67f5aef4623762b023982f2615c89cfe99 >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -1.056293727506790e+01 | -1.056293727506791e+01 | 1.060000000000000e-13 | 1.065814103640150e-14 | PASS |
| Energy [step 5] | -1.040745483159455e+01 | -1.040745483159455e+01 | 1.040000000000000e-13 | 1.776356839400250e-15 | PASS |
| Energy [step 10] | -1.040743417507011e+01 | -1.040743417507012e+01 | 1.040000000000000e-13 | 1.065814103640150e-14 | PASS |
| Energy [step 15] | -1.040742113639585e+01 | -1.040742113639586e+01 | 1.040000000000000e-13 | 7.105427357601002e-15 | PASS |
| Energy [step 20] | -1.040741451973631e+01 | -1.040741451973633e+01 | 1.040000000000000e-13 | 1.598721155460225e-14 | PASS |
| Dipole [step 1] | -6.177651164056274e-17 | 1.780638116610150e-16 | 6.600000000000000e-15 | -2.398403233015777e-16 | PASS |
| Dipole [step 5] | -7.295426719525303e-01 | -7.295426719525250e-01 | 3.650000000000000e-14 | -5.329070518200751e-15 | PASS |
| Dipole [step 10] | -1.337803863058585e+00 | -1.337803863058600e+00 | 1.970000000000000e-14 | 1.487698852997710e-14 | PASS |
| Dipole [step 15] | -1.828601499014718e+00 | -1.828601499014715e+00 | 1.830000000000000e-14 | -2.664535259100376e-15 | PASS |
| Dipole [step 20] | -2.205209055720854e+00 | -2.205209055720854e+00 | 2.210000000000000e-14 | 0.000000000000000e+00 | PASS |