Input 12-electronic_subsystem_propagators.03-aetrs.inp

Commits > Commit 58dcf5562fbb52d037ca78866f8fd352b3754746 > Run intel-2022b_impi

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205383e+01 -1.060684240205380e+01 5.000000000000000e-13 -3.197442310920451e-14 PASS
Energy [step 20] -1.060634826182159e+01 -1.060634826182150e+01 5.000000000000000e-13 -9.237055564881302e-14 PASS
Multipoles [step 0] 3.535882524274836e-16 0.000000000000000e+00 5.000000000000000e-15 3.535882524274836e-16 PASS
Multipoles [step 20] -1.265537671052366e-01 -1.265537671052304e-01 5.000000000000000e-14 -6.161737786669619e-15 PASS
Compare to other inputs