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Dynamical simulation of a combined polaron in pernigraniline-base polymer

✍ Scribed by Y. Zhang; J. Liu


Book ID
116897499
Publisher
Elsevier Science
Year
2005
Tongue
English
Weight
211 KB
Volume
151
Category
Article
ISSN
0379-6779

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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