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

Commits > Commit bf0f47cf3302df97f9487d18148dd4e0cf599eb9 > Run foss-2022a_omp

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -3.215432382877935e+00 -3.215432382877802e+00 4.120000000000000e-13 -1.332267629550188e-13 PASS
M-solvent int. energy @ t=5*dt -3.215432384511199e+00 -3.215432384511066e+00 2.800000000000000e-13 -1.327826737451687e-13 PASS
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