Ergodicity of the Nosé–Hoover method

Ergodicity of the Nosé–Hoover method
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Nosé–Hoover 方法的遍历性

DOI:
10.1080/08927020601075311
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发表时间:
2006
影响因子:
2.1
通讯作者:
Hiroto Kobayashi
Hiroto Kobayashi
中科院分区:
化学4区
文献类型:
--
作者:
Hiroshi Watanabe;Hiroto Kobayashi

文献摘要

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Ergodicity of the systems with Nosé–Hoover thermostat are studied. The dynamics of the heatbath variables are investigated and they can be periodic when the system has quick oscillation. Their periodic behaviour causes the system to lose its ergodicity. The kinetic-moments method is also studied, and the heatbath variables in this method are found to be chaotic. The chaotic behaviour makes the whole system ergodic.