Thermodynamic Properties of Star Shaped Polymers Investigated with Wang-Landau Monte Carlo Simulations

被引：3
|
作者：
Silantyeva, I. A. [1 ]
Vorontsov-Velyaminov, P. N. [1 ]
机构：
[1] St Petersburg State Univ, St Petersburg 198504, Russia
来源：
MACROMOLECULAR SYMPOSIA | 2012年 / 317卷 / 01期
关键词：
Monte Carlo; polymers; star polymers; Wang-Landau algorithm; ALGORITHM;
D O I：
10.1002/masy.201200015
中图分类号：
O63 [高分子化学（高聚物）];
学科分类号：
070305 ; 080501 ; 081704 ;
摘要：
Entropic sampling method within Wang-Landau algorithm is used for simulation of lattice models of linear polymer chains and 6-arm star-shaped polymers. The semi-phantom (i.e. nonreversal) random walk on 3D simple cubic lattice is used as a reference system. The densities of states are obtained and on their basis the temperature dependences of internal energy, heat capacity, entropy and mean square radius of gyration are calculated. Results for stars are compared with data for linear chains.
引用
收藏
页码：267 / 275
页数：9
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