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Molecular Dynamics Simulations of Polyelectrolyte Solutions: Nonuniform Stretching of Chains and Scaling Behavior

โœ Scribed by Liao, Qi; Dobrynin, Andrey V.; Rubinstein, Michael


Book ID
120420796
Publisher
American Chemical Society
Year
2003
Tongue
English
Weight
295 KB
Volume
36
Category
Article
ISSN
0024-9297

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โœ LEMAK, A. S.; BALABAEV, N. K. ๐Ÿ“‚ Article ๐Ÿ“… 1996 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 834 KB

This article describes the collisional dynamics (CD) method adapted for molecules with geometrical constraints within a description using Cartesian coordinates for the atoms. In the CD method, stochastic collisions with virtual particles are included in usual molecular dynamics simulations to couple