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Surface alloy formation, short-range order, and deuterium adsorption properties of monolayer PdRu/Ru(0001) surface alloys

机译:单层PdRu / Ru(0001)表面合金的表面合金形成,短程有序和氘吸附特性

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The formation and structure of monolayer PdRu/Ru(0001) surface alloys and their adsorption properties with respect to deuterium adsorption were investigated by atomic resolution scanning tunneling microscopy and by temperature programmed desorption. Surface alloys, prepared by deposition of up to one monolayer of Pd and flash annealing to 1150 K show (ⅰ) negligible loss of Pd by desorption or diffusion into the Ru bulk during this procedure and (ⅱ) dominant phase separation into 2D Pd and Ru islands, in contrast to the random distribution in PtRu/Ru(0001) surface alloys [H.E. Hoster, A. Bergbreiter, P.M. Erne, T. Hag-er, H. Rauscher, R.J. Behm, Phys. Chem. Chem. Phys. 10 (2008) 3812]. 2D short-range order parameters and the abundance of specific adsorption ensembles were evaluated for different Pd contents, effective pair interaction (EPI) energies were derived from Monte Carlo simulations. Deuterium adsorption on Pd monolayer films shows a pronounced weakening of adsorption bond, which is attributed to compressive strain and metal-metal interactions between Pd and underlying Ru atoms ('vertical ligand effect'). Mixed adsorption ensembles containing both Pd and Ru atoms give rise to D_2 desorption in the intermediate temperature regime. The impact of the specific lateral distribution of the two metal species on the chemical surface properties is illustrated by comparison with deuterium adsorption on dispersed PtRu/Ru(0001) surface alloys [T. Diemant, H. Rauscher, R.J. Behm.J. Phys. Chem. C 112 (2008) 8381].
机译:通过原子分辨率扫描隧道显微镜和程序升温脱附技术研究了单层PdRu / Ru(0001)表面合金的形成,结构及其对氘的吸附性能。通过沉积多达一层的Pd并快速退火至1150 K制备的表面合金显示(ⅰ)在此过程中通过解吸或扩散到Ru块中而造成的Pd损失可忽略不计,以及(ⅱ)分离成2D Pd和Ru的主要相分离岛,与PtRu / Ru(0001)表面合金中的随机分布形成对比[HE主持人A.Bergbreiter,PM厄恩(Erne),T。 Behm,物理。化学化学物理10(2008)3812]。针对不同的Pd含量,评估了二维短程参数和特定吸附团的丰度,并从Monte Carlo模拟中得出了有效的对相互作用(EPI)能量。氘在Pd单层膜上的吸附显示出吸附键的明显减弱,这归因于Pd与下面的Ru原子之间的压缩应变和金属-金属相互作用(“垂直配体效应”)。包含Pd和Ru原子的混合吸附团在中间温度范围内引起D_2解吸。通过与氘在分散的PtRu / Ru(0001)表面合金上的氘吸附进行比较,可以说明两种金属物种的特定横向分布对化学表面性能的影响。 Diemant,H。Rauscher,R.J。贝姆物理化学C 112(2008)8381]。

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