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arXiv 0712.4361cond-mat.stat-mechcond-mat.dis-nn
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正方晶格上长杆系统的熵驱动相变

Entropy-driven phase transition in a system of long rods on a square lattice

D. H. Linares, F. Roma, A. J. Ramirez-Pastor

摘要:

采用蒙特卡罗模拟和理论分析相结合的方法,研究了正方晶格上长为k的刚性长直杆系统的各向同性相变(I-N)相变.通过比较系统的构型熵与对应于完全对准系统的构型熵,分析了该过程,其计算减少到一维情况。得到的结果(1)允许估计导致α相形成的k的最小值,并对这个临界值提供了有趣的解释;(2)提供第二次相变存在的数值证据(从一个电子态到一个非电子态)发生在密度接近于1和(3)时允许测试的主要理论模型的预测开发处理聚合物吸附问题。

英文摘要:

The isotropic-nematic (I-N) phase transition in a system of long straight rigid rods of length k on square lattices is studied by combining Monte Carlo simulations and theoretical analysis. The process is analyzed by comparing the configurational entropy of the system with the corresponding to a fully aligned system, whose calculation reduces to the 1D case. The results obtained (1) allow to estimate the minimum value of k which leads to the formation of a nematic phase and provide an interesting interpretation of this critical value; (2) provide numerical evidence on the existence of a second phase transition (from a nematic to a non-nematic state) occurring at density close to 1 and (3) allow to test the predictions of the main theoretical models developed to treat the polymers adsorption problem.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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