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Fluctuating-charge models (FCMs), also known as chemical potential equilibration models, can describe charge transfer in molecular mechanics (MM). Examples of FCMs are QEq [1], \textit{fluc}-q (FQ) [2], and our recently proposed... more
Fluctuating-charge models (FCMs), also known as chemical potential equilibration models, can describe charge transfer in molecular mechanics (MM). Examples of FCMs are QEq [1], \textit{fluc}-q (FQ) [2], and our recently proposed PE-CC-QVB2 [3] and QTPIE [4]. FCMs ...
