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Some Remarks on Free Energy and Coarse-Graining

机译:关于自由能和粗谷的一些评论

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We present recent results on coarse-graining techniques for thcrmody-namic quantities (canonical averages) and dynamical quantities (averages of path functionals over solutions of overdampcd Langevin equations). The question is how to obtain reduced models to compute such quantities, in the specific case when the functional to be averaged only depends on a few degrees of freedom. We mainly review, numerically illustrate and extend results from (Blanc ct al. Journal of Nonlinear Science 20(2):241-275, 2010; Legoll and Lelievre Nonlinearity 23(9):2131-2163, 2010.), concerning the computation of the stress-strain relation for one-dimensional chains of atoms, and the construction of an effective dynamics for a scalar coarse-grained variable when the complete system evolves according to the overdamped Langevin equation.
机译:我们在最近的结果上存在粗晶量(规范平均值)和动力量的粗磨削技术(通过过度堆积Langevin方程的解决方案的路径功能的平均值)。问题是如何在特定情况下获取减少模型来计算这些数量,当要平均的功能仅取决于几个自由度时。我们主要是审查,数值表现出并扩展了(Blanc CT Al。非线性科学杂志20(2):241-275,2010;纵叶和Lelievre非线性23(9):2131-2163,2010。),关于计算作者:张莹莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王莹,王玮

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