Input 06-caetrs.02-kick.inp
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_omp_autotools: [foss2023a-serial]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 1] | -1.056293727506792e+01 | -1.056293727506791e+01 | 1.060000000000000e-13 | -8.881784197001252e-15 | PASS |
Energy [step 5] | -1.040745483159455e+01 | -1.040745483159455e+01 | 1.040000000000000e-13 | 1.776356839400250e-15 | PASS |
Energy [step 10] | -1.040743417507012e+01 | -1.040743417507012e+01 | 1.040000000000000e-13 | -1.776356839400250e-15 | PASS |
Energy [step 15] | -1.040742113639586e+01 | -1.040742113639586e+01 | 1.040000000000000e-13 | 3.552713678800501e-15 | PASS |
Energy [step 20] | -1.040741451973633e+01 | -1.040741451973633e+01 | 1.040000000000000e-13 | -3.552713678800501e-15 | PASS |
Dipole [step 1] | -2.658344735746027e-16 | 1.780638116610150e-16 | 6.600000000000000e-15 | -4.438982852356177e-16 | PASS |
Dipole [step 5] | -7.295426719525289e-01 | -7.295426719525250e-01 | 3.650000000000000e-14 | -3.885780586188048e-15 | PASS |
Dipole [step 10] | -1.337803863058590e+00 | -1.337803863058600e+00 | 1.970000000000000e-14 | 9.769962616701378e-15 | PASS |
Dipole [step 15] | -1.828601499014708e+00 | -1.828601499014715e+00 | 1.830000000000000e-14 | 6.661338147750939e-15 | PASS |
Dipole [step 20] | -2.205209055720841e+00 | -2.205209055720854e+00 | 2.210000000000000e-14 | 1.287858708565182e-14 | PASS |