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The Interaction of CO and W(111) Surface

机译:CO与W(111)表面的相互作用

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The adsorption of CO on W(111) surface in the range of adsorption temperature between 300 K and 1000 K has been studied using AES, LEED, and TDS in an UHV system. After CO saturation at 300 K, four desorption peaks are observed at temperatures (K) of about 400, 850, 1000, and 1100 in thermal desorption spectra, called as メ, モ1, モ2, and モ3 state, respectively. The state was attributed to molecular species of CO, which is well known. Because the CO in モstates (especially the モ3 state) is still debated as to whether it is dissociative or non-dissociative, the モ3 state is mainly discussed. By using the variation method of heating rate in the thermal desorption spectrometry, the desorption energy and pre-exponential factor for the モ3 state are evaluated to be 280 kJ/mol and 1.5】10 12 s-1 , respectively. A lateral interaction energy of 5.7 kJ/mol can also be estimated by Bragg-Williams approximation. To interpret the thermal desorption spectra for the モ3 state, moreover, those for the model of a first order and a second order desorption are simulated using quasi-chemical approximation. In this study, a model of lying-down CO species is proposed for the モ3 state of CO adsorption.
机译:在UHV系统中,使用AES,LEED和TDS研究了CO在W(111)表面在300 K和1000 K吸附温度范围内的吸附。在300 K的CO饱和后,在热解吸光谱中分别在约400、850、1000和1100的温度(K)处观察到四个解吸峰,分别称为メ,モ1,钼2和Μ3状态。该状态归因于众所周知的CO分子种类。由于mo状态(尤其是mo3状态)中的CO仍是关于解离性还是非解离性的争论,因此主要讨论mos3状态。采用热解吸光谱法中升温速率的变化方法,对mo3态的解吸能量和指数前因子分别为280 kJ / mol和1.5】10 12 s-1。还可通过布拉格-威廉斯(Bragg-Williams)近似估算出5.7 kJ / mol的横向相互作用能。为了解释mo3态的热脱附光谱,此外,使用准化学逼近法模拟了一阶和二阶脱附模型的热脱附光谱。在这项研究中,为CO吸附的mo3状态,提出了一个躺下的CO物种模型。

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