Unraveling weak interactions between fluorinated gases and ionic liquids

VMD: Visual molecular dynamics

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Multiwfn: A multifunctional wavefunction analyzer

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Natural Sciences, Chemistry, Visualization +15

Effect of the damping function in dispersion corrected density functional theory

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Natural Sciences, Chemistry, Physics +10

UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations

Anthony K. Rappé, C. J. Casewit, K. S. Colwell et al. · Journal of the American Chemical Society · 1992 · 10.4K citations

Natural Sciences, Chemistry, Physics +14

Revealing Noncovalent Interactions

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Natural Sciences, Chemistry, Medicinal Chemistry +17