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

Commits > Commit 22a7b3628f7ddff53691f80b422d9224cf7a2498 > Run spack_foss-2023a_serial_opt

Matches

Name Value Reference Precision Difference Status
M-solvent int. energy @ t=0 -3.215406787815822e+00 -3.215406787815954e+00 2.790000000000000e-13 1.327826737451687e-13 PASS
M-solvent int. energy @ t=5*dt -3.215406787112951e+00 -3.215406787112854e+00 2.000000000000000e+00 -9.769962616701378e-14 PASS
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