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

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Run foss_mpi_omp_autotools: [foss2023a-mpi]

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 -3.215406787112855e+00 -3.215406787112854e+00 2.000000000000000e+00 -8.881784197001252e-16 PASS
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