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

Commits > Commit c7ac96946c926bee5c46ca4221093c1f60753f5a > Run spack_intel-2022a_serial_omp

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -3.215406787815846e+00 -3.215406787815954e+00 2.790000000000000e-13 1.088018564132653e-13 PASS
M-solvent int. energy @ t=5*dt -3.215406787112806e+00 -3.215406787112854e+00 2.000000000000000e+00 4.751754545395670e-14 PASS
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