Input 06-caetrs.02-kick.inp

Commits > Commit b5086f89e5ba3598cb2c5ef57ca1b3f99761e498 > Run foss_cmake: [foss2023a-mpi, foss-min-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.056293727506792e+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] -1.040743417507013e+01 -1.040743417507012e+01 1.040000000000000e-13 -1.065814103640150e-14 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 0.000000000000000e+00 PASS
Dipole [step 1] 0.000000000000000e+00 1.780638116610150e-16 6.600000000000000e-15 -1.780638116610150e-16 PASS
Dipole [step 5] -7.295426719525144e-01 -7.295426719525250e-01 3.650000000000000e-14 1.054711873393899e-14 PASS
Dipole [step 10] -1.337803863058618e+00 -1.337803863058600e+00 1.970000000000000e-14 -1.842970220877760e-14 PASS
Dipole [step 15] -1.828601499014721e+00 -1.828601499014715e+00 1.830000000000000e-14 -5.995204332975845e-15 PASS
Dipole [step 20] -2.205209055720868e+00 -2.205209055720854e+00 2.690000000000000e-14 -1.376676550535194e-14 PASS
Compare to other inputs