Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit 97b4f3224f9be7c1ae7006b6639b45be6cefbdcd > Run cmake_foss_2022a_min_mpi

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205381e+01 -1.060684240205380e+01 5.000000000000000e-13 -1.421085471520200e-14 PASS
Energy [step 20] -1.060634826182158e+01 -1.060634826182150e+01 5.000000000000000e-13 -7.815970093361102e-14 PASS
Multipoles [step 0] 1.510765877633588e-15 0.000000000000000e+00 5.000000000000000e-15 1.510765877633588e-15 PASS
Multipoles [step 20] -1.265537671052358e-01 -1.265537671052304e-01 5.000000000000000e-14 -5.412337245047638e-15 PASS
Compare to other inputs