Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run eb_foss-2022a_valgrind

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205383e+01 -1.060684240205380e+01 5.000000000000000e-13 -2.664535259100376e-14 PASS
Energy [step 20] -1.060634826182159e+01 -1.060634826182150e+01 5.000000000000000e-13 -8.526512829121202e-14 PASS
Multipoles [step 0] 2.107373052917440e-15 0.000000000000000e+00 5.000000000000000e-15 2.107373052917440e-15 PASS
Multipoles [step 20] -1.265537671052370e-01 -1.265537671052304e-01 5.000000000000000e-14 -6.578071420904053e-15 PASS
Compare to other inputs