Input 01-propagators.08-cn.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run intel-2022a_impi

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205383e+01 -1.060684240205380e+01 5.300000000000000e-14 -3.197442310920451e-14 PASS
Energy [step 20] -1.060634888678688e+01 -1.060634888678690e+01 5.300000000000000e-14 1.953992523340276e-14 PASS
Multipoles [step 0] 2.062177211219381e-15 2.282730401188460e-15 4.670000000000000e-15 -2.205531899690792e-16 PASS
Multipoles [step 20] -1.265308523247589e-01 -1.265308523249920e-01 2.570000000000000e-13 2.330913240200516e-13 PASS
Forces [step 0] 8.537491810749254e-02 8.537491810749601e-02 8.300000000000000e-15 -3.469446951953614e-15 PASS
Forces [step 20] 7.964815083722199e-02 7.964815083600001e-02 3.980000000000000e-11 1.221980849841486e-12 PASS
Compare to other inputs