Search

Now showing items 1-1 of 1

Modeling the interaction of a neutral polymer with small ions in solution. A theoretical study of ion binding to a neutral polymer

Contreras Ramos, Renato; Mendizábal Emaldía, Fernando; Aizman, Arie (Kluwer Academic Publishers, 1992)

The interaction between NaCl and 1,2-dimethoxyethylene is used to model ion binding to a neutral polymer. The relative binding energies involving different ion-polymer structures were calculated using minimal basis STO-3G ...