Input 02-propagators.02-cnsparskit.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run eb_foss-2022b_libxc6

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537491810749520e-02 8.537491810749601e-02 8.300000000000000e-15 -8.049116928532385e-16 PASS
Forces [step 20] 7.964818149493214e-02 7.964818149493391e-02 4.400000000000000e-15 -1.776356839400250e-15 PASS
Energy [step 1] -1.060684240205381e+01 -1.060684240205380e+01 5.300000000000000e-14 -8.881784197001252e-15 PASS
Energy [step 20] -1.060634890211196e+01 -1.060634890211200e+01 5.300000000000000e-12 3.730349362740526e-14 PASS
Multipoles [step 1] -9.703059278905364e-16 2.282730401188460e-15 4.670000000000000e-15 -3.253036329078996e-15 PASS
Multipoles [step 20] -1.265308695811649e-01 -1.265308695811640e-01 6.330000000000000e-15 -8.881784197001252e-16 PASS
Compare to other inputs