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Molecular composites formed by solutions of a rodlike polymer (PBT) in polyphosphoric acid

✍ Scribed by A.F. Charlet; G.C. Berry


Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
504 KB
Volume
30
Category
Article
ISSN
0032-3861

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Molecular dynamics simulation of a polym
✍ LEMAK, A. S.; BALABAEV, N. K. πŸ“‚ Article πŸ“… 1996 πŸ› John Wiley and Sons 🌐 English βš– 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