Input 01-propagators.03-etrs_taylor.inp

Commits > Commit b7dcc99023940be2b83de00317ffa33e598f3f55 > Run foss_opt_autotools: [foss2023a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766760e+01 -1.060686608766762e+01 1.060000000000000e-13 1.776356839400250e-14 PASS
Energy [step 20] -1.060637205318229e+01 -1.060637205318229e+01 1.060000000000000e-13 5.329070518200751e-15 PASS
Multipoles [step 0] -7.776088123022037e-16 1.824331091466839e-16 4.490000000000000e-15 -9.600419214488876e-16 PASS
Multipoles [step 20] -1.265536606512529e-01 -1.265536606512522e-01 4.000000000000000e-15 -6.938893903907228e-16 PASS
Forces [step 0] 8.537673799433554e-02 8.537673799433354e-02 1.250000000000000e-14 1.998401444325282e-15 PASS
Forces [step 20] 7.966960326023287e-02 7.966960326023464e-02 7.820000000000000e-15 -1.776356839400250e-15 PASS
Compare to other inputs