Input 05-time_propagation.05-td_md.inp

Commits > Commit f1dbe11076ccb3bb542605fe66566061d8720041 > Run spack_intel-2023a_serial

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -3.791009280177400e+01 -3.791009280177000e+01 1.900000000000000e-10 -4.000355602329364e-12 PASS
Energy [step 5] -3.791008856892510e+01 -3.791008856893000e+01 1.900000000000000e-10 4.895639449387090e-12 PASS
Energy [step 10] -3.791001520298099e+01 -3.791001520298000e+01 1.900000000000000e-10 -9.876544027065393e-13 PASS
Compare to other inputs