Input 29-pcm_chlorine_anion.02-td_prop-n60.inp

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run intel-2022b_impi

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -3.215406787815942e+00 -3.215406787815954e+00 2.790000000000000e-13 1.199040866595169e-14 PASS
M-solvent int. energy @ t=5*dt -3.215406787112806e+00 -3.215406787112854e+00 1.060000000000000e-13 4.751754545395670e-14 PASS
Compare to other inputs