Input 05-time_propagation.05-td_md.inp

Commits > Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 > Run spack_foss-2023a_serial_opt

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -3.791009280177379e+01 -3.791009280177000e+01 1.900000000000000e-10 -3.794298208958935e-12 PASS
Energy [step 5] -3.791008856892490e+01 -3.791008856893000e+01 1.900000000000000e-10 5.101696842757519e-12 PASS
Energy [step 10] -3.791001520298113e+01 -3.791001520298000e+01 1.900000000000000e-10 -1.129762949858559e-12 PASS
Compare to other inputs