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首页> 外文期刊>The Journal of Chemical Physics >Modeling anisotropic chemical wave patterns in the NO+H-2 reaction on a Rh(110) surface
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Modeling anisotropic chemical wave patterns in the NO+H-2 reaction on a Rh(110) surface

机译:模拟Rh(110)表面NO + H-2反应中的各向异性化学波型

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A realistic mathematical model describing the formation of anisotropic chemical wave patterns in the NO + H-2 reaction on a Rh(110) surface is presented. For the point model describing the local reaction kinetics a bifurcation analysis has been conducted. In order to take into account the state-dependent anisotropy of surface diffusion site-blocking effects through coadsorbates for the diffusing species were introduced. The spatially distributed model reproduces well the experimentally determined excitability and bistability range and the existence ranges for the different types of chemical wave patterns: elliptical and rectangular target patterns, travelling wave fragments, and varying front geometries in the range of double metastability were modeled. In addition, the dependencies of the pulse/front velocity on the hydrogen partial pressure and temperature were simulated. (C) 2001 American Institute of Physics. [References: 47]
机译:提出了一个现实的数学模型,描述了Rh(110)表面NO + H-2反应中各向异性化学波型的形成。对于描述局部反应动力学的点模型,进行了分叉分析。为了考虑到表面扩散的状态依赖性的各向异性,通过共吸附物对扩散物质进行了位阻。空间分布模型很好地再现了实验确定的兴奋性和双稳性范围,以及不同类型的化学波模式的存在范围:对椭圆和矩形目标模式,行波碎片以及双亚稳范围内的变化的前部几何形状进行了建模。另外,模拟了脉冲/前沿速度对氢分压和温度的依赖性。 (C)2001美国物理研究所。 [参考:47]

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