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

Commits > Commit c9606f298ccf4e57d14167459d26815f7508aa3e > Run foss_min_autotools: [foss2023b-serial]

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -3.215406787815894e+00 -3.215406787815846e+00 2.120000000000000e-13 -4.796163466380676e-14 PASS
M-solvent int. energy @ t=5*dt -3.215406787112903e+00 -3.215406787112854e+00 2.000000000000000e+00 -4.929390229335695e-14 PASS
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