Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit e2663e21d2b19b776c1ae6497ca3d74f14dbf310 > Run eb_fosscuda-2022a_mpi_omp

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] -6.255269739685598e-16 0.000000000000000e+00 5.000000000000000e-15 -6.255269739685598e-16 PASS
Multipoles [step 20] -1.265537671052354e-01 -1.265537671052304e-01 5.000000000000000e-14 -5.051514762044462e-15 PASS
Compare to other inputs