Input 06-caetrs.04-kick-tp2.inp
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss-cmake-zen4: [foss2023a-serial, foss-min]
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 | -5.329070518200751e-15 | PASS |
| Energy [step 10] | -1.040743417507011e+01 | -1.040743417507012e+01 | 1.040000000000000e-13 | 1.065814103640150e-14 | PASS |
| Energy [step 15] | -1.040742113639586e+01 | -1.040742113639585e+01 | 1.040000000000000e-13 | -5.329070518200751e-15 | PASS |
| Energy [step 20] | -1.040741451973632e+01 | -1.040741451973633e+01 | 1.040000000000000e-13 | 1.065814103640150e-14 | PASS |
| Dipole [step 1] | -3.607521995973445e-16 | 1.494990959640600e-16 | 6.600000000000000e-15 | -5.102512955614045e-16 | PASS |
| Dipole [step 5] | -7.295426719525296e-01 | -7.295426719525300e-01 | 3.650000000000000e-14 | 3.330669073875470e-16 | PASS |
| Dipole [step 10] | -1.337803863058585e+00 | -1.337803863058586e+00 | 1.340000000000000e-14 | 6.661338147750939e-16 | PASS |
| Dipole [step 15] | -1.828601499014718e+00 | -1.828601499014712e+00 | 1.830000000000000e-14 | -5.551115123125783e-15 | PASS |
| Dipole [step 20] | -2.205209055720854e+00 | -2.205209055720848e+00 | 2.210000000000000e-14 | -5.773159728050814e-15 | PASS |