Input 05-time_propagation.05-td_md.inp

Commits > Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa > Run spack_intel-2023a_impi

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -3.791009280177374e+01 -3.791009280177000e+01 1.900000000000000e-10 -3.737454790098127e-12 PASS
Energy [step 5] -3.791008856892484e+01 -3.791008856893000e+01 1.900000000000000e-10 5.158540261618327e-12 PASS
Energy [step 10] -3.791001520298087e+01 -3.791001520298000e+01 1.900000000000000e-10 -8.739675649849232e-13 PASS
Compare to other inputs