Input 01-propagators.08-cn.inp

Commits > Commit babc485c55a2119a415aa56305cb49f398154cb7 > Run spack_foss-2022a_serial_opt

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205380e+01 -1.060684240205380e+01 5.300000000000000e-14 -3.552713678800501e-15 PASS
Energy [step 20] -1.060634888678689e+01 -1.060634888678690e+01 5.300000000000000e-14 1.065814103640150e-14 PASS
Multipoles [step 0] -6.215055325855396e-16 2.282730401188460e-15 4.670000000000000e-15 -2.904235933773999e-15 PASS
Multipoles [step 20] -1.265308523252200e-01 -1.265308523249920e-01 2.570000000000000e-13 -2.279842981067759e-13 PASS
Forces [step 0] 8.537491810749342e-02 8.537491810749601e-02 8.799999999999999e-15 -2.581268532253489e-15 PASS
Forces [step 20] 7.964815083499532e-02 7.964815083600001e-02 3.980000000000000e-11 -1.004682448346728e-12 PASS
Compare to other inputs