Mechanisms of decarboxylation of ortho-substituted benzoic acids

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An improved algorithm for reaction path following

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Reaction path following in mass-weighted internal coordinates

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High resolution UV spectroscopy of phenol and the hydrogen bonded phenol-water cluster

Giel Berden, W. Leo Meerts, Michaël Schmitt et al. · The Journal of Chemical Physics · 1996 · 246 citations

Natural Sciences, Chemistry, Physics +17