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Kinetics of physical adsorption of ethane on Ir(110)-(1×2): Molecular beam reflectivity measurements and Monte Carlo simulations

机译:乙烷在Ir(110)-(1×2)上的物理吸附动力学:分子束反射率测量和蒙特卡洛模拟

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摘要

Experimental results, obtained using a reflectivity method, for the probability of physical adsorption of ethane on the Ir(110)-(1×2) surface are presented. We analyze these results using Monte Carlo simulations and show that physical adsorption can occur either directly or through a precursor state in which an ethane molecule is trapped in a second layer above a first layer of physically adsorbed ethane. From the Monte Carlo simulations, we are able to establish that the energy barrier for desorption of an ethane molecule from the precursor state is ~4.5 kcal/mol. We also find that the energy barrier for diffusion of an ethane molecule on top of a monolayer of physically adsorbed ethane on the Ir(110) surface is ~3.7 kcal/mol.
机译:提出了使用反射率方法获得的实验结果,表明乙烷在Ir(110)-(1×2)表面上发生物理吸附的可能性。我们使用蒙特卡洛模拟分析这些结果,并表明物理吸附可以直接发生,也可以通过前体状态发生,其中乙烷分子被困在第一层物理吸附的乙烷上方的第二层。根据蒙特卡洛模拟,我们能够确定乙烷分子从前体状态解吸的能垒为〜4.5 kcal / mol。我们还发现,Ir(110)表面上物理吸附的乙烷单层顶部上的乙烷分子扩散的能垒为〜3.7 kcal / mol。

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