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Computer Modelling of Dense Polymer Systems

Pavel Gennadievich Khalatur 1
Pavel Gennadievich Khalatur
, 
S G Pletneva 1
S G Pletneva
, 
German Nikolaevich Marchenko 1
German Nikolaevich Marchenko
1 Kalininsky State University
Published 30 November 1985
Communication , Volume 55, Issue 4, 357-376
3
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Khalatur P. G., Pletneva S. G., Marchenko G. N. Computer Modelling of Dense Polymer Systems // Russian Chemical Reviews. 1986. Vol. 55. No. 4. pp. 357-376.
GOST all authors (up to 50)
Khalatur P. G., Pletneva S. G., Marchenko G. N. Computer Modelling of Dense Polymer Systems // Russian Chemical Reviews. 1986. Vol. 55. No. 4. pp. 357-376.
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TY - JOUR
DO - 10.1070/RC1986v055n04ABEH003195
UR - https://rcr.colab.ws/publications/10.1070/RC1986v055n04ABEH003195
TI - Computer Modelling of Dense Polymer Systems
T2 - Russian Chemical Reviews
AU - Khalatur, Pavel Gennadievich
AU - Pletneva, S G
AU - Marchenko, German Nikolaevich
PY - 1986
DA - 1985/11/30
PB - ANO Editorial Board of the journal Uspekhi Khimii
SP - 357-376
IS - 4
VL - 55
ER -
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@article{1986_Khalatur,
author = {Pavel Gennadievich Khalatur and S G Pletneva and German Nikolaevich Marchenko},
title = {Computer Modelling of Dense Polymer Systems},
journal = {Russian Chemical Reviews},
year = {1986},
volume = {55},
publisher = {ANO Editorial Board of the journal Uspekhi Khimii},
month = {Nov},
url = {https://rcr.colab.ws/publications/10.1070/RC1986v055n04ABEH003195},
number = {4},
pages = {357--376},
doi = {10.1070/RC1986v055n04ABEH003195}
}
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Khalatur, Pavel Gennadievich, et al. “Computer Modelling of Dense Polymer Systems.” Russian Chemical Reviews, vol. 55, no. 4, Nov. 1986, pp. 357-376. https://rcr.colab.ws/publications/10.1070/RC1986v055n04ABEH003195.
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Abstract

The application of the Monte Carlo method and the methods of molecular and Brownian dynamics to the study of the structures and dynamic properties of dense polymer systems with a strong intermolecular interaction is examined. The methodological problems arising in the computer modelling of polymers are discussed. Data obtained in numerical experiments on computers for solutions of macromolecules in a low-molecular-weight solvent, semidilute polymer solutions, liquid and amorphous polymers, as well as partly ordered systems (liquid and rotation crystals) are surveyed. The results of the computer experiments are compared with the conclusions arising from modern analytical theory. The limitations of the numerical methods and the prospects for their further development are considered.
The bibliography includes 195 references.