Input 05-time_propagation.05-td_md.inp

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Run spack_foss-2022a_cuda_serial

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -3.791009280177380e+01 -3.791009280177000e+01 1.900000000000000e-10 -3.801403636316536e-12 PASS
Energy [step 5] -3.791008856892491e+01 -3.791008856893000e+01 1.900000000000000e-10 5.094591415399918e-12 PASS
Energy [step 10] -3.791001520298109e+01 -3.791001520298000e+01 1.900000000000000e-10 -1.087130385712953e-12 PASS
Compare to other inputs