𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Polaron dynamics and Peierls–Nabarro barrier in a discrete molecular chain

✍ Scribed by L. Brizhik; L. Cruzeiro-Hansson; A. Eremko; Yu. Olkhovska


Book ID
117543587
Publisher
Elsevier Science
Year
2000
Tongue
English
Weight
94 KB
Volume
109
Category
Article
ISSN
0379-6779

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Molecular dynamics simulation of a polym
✍ LEMAK, A. S.; BALABAEV, N. K. 📂 Article 📅 1996 🏛 John Wiley and Sons 🌐 English ⚖ 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

Molecular dynamics simulation of a poly(
✍ M. Depner; B.L. Schürmann 📂 Article 📅 1992 🏛 John Wiley and Sons 🌐 English ⚖ 598 KB

Molecular dynamics simulations of pure benzene and a poly(oxyethy1ene) chain in benzene are performed. The simulation of pure benzene is found to agree excellently with previous simulations despite using a different force field. A comparison is made between the results of simulations of the poly(oxy