Artículos de revistas
Computer simulation of configurational properties of partially ionized polyelectrolytes
Date
1993-05-01Registration in:
Journal of Molecular Structure: THEOCHEM, v. 282, n. 1-2, p. 167-174, 1993.
0166-1280
10.1016/0166-1280(93)85047-3
WOS:A1993LH86000022
2-s2.0-5244301379
4167514050938821
Author
Universidade de São Paulo (USP)
Universidade Estadual Paulista (Unesp)
Institutions
Abstract
Monte Carlo simulation methods were used in order to study the conformational properties of partially ionized polyelectrolyte chains with Debye-Hückel screening in 1:1 electrolyte solution at room temperature. Configurational properties such as the distributions of probability for the square end to end distances, for the square radii of gyration and for the angles between polyion bonds were investigated as a function of the chain ionization and the salt concentration. © 1993.