Assessment of standard force field models against high-quality ::::ab initio:::: potential curves for prototypes of pi-pi, CH/pi, and SH/pi interactions

C. David Sherrill, Bobby G. Sumpter, Mutasem O. Sinnokrot, Michael S. Marshall, Edward G. Hohenstein, Ross C. Walker, Ian R. Gould. Assessment of standard force field models against high-quality ::::ab initio:::: potential curves for prototypes of pi-pi, CH/pi, and SH/pi interactions. Journal of Computational Chemistry, 30(14):2187-2193, 2009. [doi]

Authors

C. David Sherrill

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Bobby G. Sumpter

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Mutasem O. Sinnokrot

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Michael S. Marshall

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Edward G. Hohenstein

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Ross C. Walker

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Ian R. Gould

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