Abstract

A new theory for intramolecular hydrogen bonding of flexible hard chain molecules in the absence of intermolecular association is presented. The theory predicts the change in thermodynamic properties due to intramolecular association and the fraction of nonbonded chains. Comparisons with molecular simulation results are presented to demonstrate the accuracy of the theory. By considering the limit of complete association, an accurate equation of state of cyclic molecules is obtained.

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