Input 01-propagators.03-etrs_taylor.inp

Commits > Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a > Run foss_min_autotools: [foss2023b-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] -1.060637205318230e+01 -1.060637205318229e+01 1.060000000000000e-13 -7.105427357601002e-15 PASS
Multipoles [step 0] 4.267685692143329e-15 1.824331091466839e-16 4.490000000000000e-15 4.085252582996645e-15 PASS
Multipoles [step 20] -1.265536606512505e-01 -1.265536606512522e-01 4.000000000000000e-15 1.748601263784622e-15 PASS
Forces [step 0] 8.537673799433643e-02 8.537673799433354e-02 1.250000000000000e-14 2.886579864025407e-15 PASS
Forces [step 20] 7.966960326023287e-02 7.966960326023464e-02 7.820000000000000e-15 -1.776356839400250e-15 PASS
Compare to other inputs