Input 05-time_propagation.05-td_md.inp

Commits > Commit 57f8ca8d342504024fed98c8f4356f69f5870627 > Run foss-mpi-full: [foss2023a-mpi]

Matches

Name	Value	Reference	Precision	Difference	Status
Energy [step 1]	-3.791009280177394e+01	-3.791009280177000e+01	1.900000000000000e-10	-3.943512183468556e-12	PASS
Energy [step 5]	-3.791008856892505e+01	-3.791008856893000e+01	1.900000000000000e-10	4.952482868247898e-12	PASS
Energy [step 10]	-3.791001520298097e+01	-3.791001520298000e+01	1.900000000000000e-10	-9.734435479913373e-13	PASS

Compare to other inputs