Molecular Dynamics Simulations of CO₂ Molecules in ZIF-11 Using Refined AMBER Force Field

Figure 4

The comparison between Δ𝐸_𝐶𝐶 (–), Δ𝐸_AMBER (- -), and Δ𝐸_SAMBER (–∘–) energies of some CO₂–[C₇H₅N₂]⁻ complexes.

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