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

Commits > Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 > Run foss-2022a_mpi_omp

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -3.215406787815797e+00 -3.215406787815954e+00 2.790000000000000e-13 1.572075802869222e-13 PASS
M-solvent int. energy @ t=5*dt -3.215406787112831e+00 -3.215406787112854e+00 1.060000000000000e-13 2.309263891220326e-14 PASS
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