首页> 外文期刊>The Journal of Chemical Physics >TRICRITICAL BEHAVIOR OF AN OFF-LATTICE FLEXIBLE POLYMER MODEL - MONTE CARLO CALCULATION OF SECOND VIRIAL COEFFICIENTS
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TRICRITICAL BEHAVIOR OF AN OFF-LATTICE FLEXIBLE POLYMER MODEL - MONTE CARLO CALCULATION OF SECOND VIRIAL COEFFICIENTS

机译:离格弹性聚合物模型的行为-第二维里系数的蒙特卡罗计算

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Simulation data of second virial coefficients have been obtained for an off-lattice model of linear polymer chains by means of Monte Carlo method with different values of the variable that describes intramolecular attractions between units. The data have allowed us to study the theta, or tricritical, region where binary interactions cancel out. These Monte Carlo results are quantitatively compared with numerical predictions from the tricritical renormalization group theory. With this purpose, we have employed the same values for the three-body and the cutoff theoretical parameters that were previously used to reproduce the mean size data. (C) 1997 American Institute of Physics. [References: 28]
机译:已经通过蒙特卡罗方法获得了线性聚合物链的非晶格模型的第二维里系数的模拟数据,该变量具有描述单元之间的分子内引力的变量的不同值。数据使我们能够研究二元相互作用抵消的θ或三临界区。将这些蒙特卡洛结果与三临界重归一化群理论的数值预测进行定量比较。为此,我们对三体和截止理论参数采用了相同的值,这些参数先前已用于重现平均尺寸数据。 (C)1997美国物理研究所。 [参考:28]

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