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Theoretical means for searching bimetallic alloys as anode electrocatalysts for direct liquid-feed fuel cells
被引:256
作者:
Demirci, Umit B.
[1
]
机构:
[1] Univ Strasbourg, Lab Mat & Procedes Catalyse, CNRS, UMR 7515, F-67087 Strasbourg 2, France
关键词:
direct liquid-feed fuel cell;
electrocatalyst;
alloys;
metal d-band centre;
segregation;
D O I:
10.1016/j.jpowsour.2007.04.069
中图分类号:
O64 [物理化学(理论化学)、化学物理学];
学科分类号:
070304 ;
081704 ;
摘要:
The present paper reviews the best anode electrocatalysts, mainly the alloys, which have been tested in direct liquid-feed fuel cells fed with methanol, ethanol or formic acid. It attempts to interpret the alloys catalytic behaviours by using the Norskov and co-workers' theoretical work [A. Ruban, B. Hammer, P. Stoltze, H.L. Skriver, J.X. Norskov, J. Mol. Catal. A 115 (1997) 421; B. Hammer, J.K. Norskov, Adv. Catal. 45 (2000) 71; J. Greeley, JX. Norskov, M. Maurikakis, Annu. Rev. Phys. Chem. 53 (2002) 319], who proposed surface theories and databases about the metals d-band centre shift and the segregation. It also attempts to suggest new alloys combinations. For example, for the methanol oxidation, the best catalyst is Pt-Ru and the following features make this catalyst stand out: the d-band centre of Pt shifts down what supposes weaker molecules adsorption and Pt strongly segregates. From this analysis, it is suggested that the Pd-Ni alloy may be a potentially good catalyst. Similar interpretations are given for the three fuel cell systems regarded in the present paper. (C) 2007 Elsevier B.V. All rights reserved.
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页码:11 / 18
页数:8
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