Hütter Markus, Karlin Iliya V, Ottinger Hans Christian
Department of Materials, Institute of Polymers, ETH-Zürich, CH-8092 Zürich, Switzerland.
Phys Rev E Stat Nonlin Soft Matter Phys. 2003 Jul;68(1 Pt 2):016115. doi: 10.1103/PhysRevE.68.016115. Epub 2003 Jul 15.
Complicated dynamic models are often approximated by introducing mean-field approximations and closures. The focus here is on examining such mean-field models using nonequilibrium thermodynamics. Two illustrative examples are studied in terms of the double-generator general equation for the nonequilibrium reversible-irreversible coupling (GENERIC) framework. First, it is shown that a model for the coil-stretch transition of long chains in strong elongation flows as proposed by de Gennes is thermodynamically admissible. In the second example, we study a Gaussian approximation, which is used to simplify the effect of hydrodynamic interactions in polymer solutions. This approximation, which is known to be in conflict with the fluctuation-dissipation theorem, is identified as defective directly when formulated in the thermodynamic formalism.
复杂的动力学模型通常通过引入平均场近似和封闭条件来进行近似。这里的重点是使用非平衡热力学来研究此类平均场模型。针对非平衡可逆-不可逆耦合(GENERIC)框架的双生成器通用方程,研究了两个示例。首先,结果表明,德热纳提出的长链在强拉伸流中卷曲-伸展转变的模型在热力学上是可行的。在第二个示例中,我们研究了一种高斯近似,该近似用于简化聚合物溶液中流体动力学相互作用的影响。这种近似已知与涨落耗散定理相冲突,在热力学形式体系中表述时直接被认定为有缺陷。