Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit abc749737cc12a5b79d975879ed425be2e62065f > Run eb_foss-2022b_libxc6

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205381e+01 -1.060684240205380e+01 5.000000000000000e-13 -1.065814103640150e-14 PASS
Energy [step 20] -1.060634826182156e+01 -1.060634826182150e+01 5.000000000000000e-13 -6.394884621840902e-14 PASS
Multipoles [step 0] -1.461971413070987e-15 0.000000000000000e+00 5.000000000000000e-15 -1.461971413070987e-15 PASS
Multipoles [step 20] -1.265537671052384e-01 -1.265537671052304e-01 5.000000000000000e-14 -7.965850201685498e-15 PASS
Compare to other inputs