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

Commits > Commit e5fcdd4b6e483a88fb99eafb58d1df80750fbe8c > Run intel-2022a_omp_impi

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -3.215406787815725e+00 -3.215406787815954e+00 2.790000000000000e-13 2.295941214924824e-13 PASS
M-solvent int. energy @ t=5*dt -3.215406787112879e+00 -3.215406787112854e+00 1.060000000000000e-13 -2.486899575160351e-14 PASS
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