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篇目详细内容

【篇名】 Monte Carlo simulation of hydrogen adsorption on Ni surfaces
【刊名】 Frontiers of Physics in China
【刊名缩写】 Front. Phys. China
【ISSN】 1673-3487
【EISSN】 1673-3606
【DOI】 10.1007/s11467-007-0024-5
【出版社】 Higher Education Press and Springer-Verlag
【出版年】 2007
【卷期】 2 卷2期
【页码】 199-203 页,共 5 页
【作者】 WANG Rui; DENG Hui-qiu; YUAN Xiao-jian; HU Wang-yu;
【关键词】 adsorption isotherm; Monte Carlo simulation; hydrogen

【摘要】
In the present paper the adsorption kinetics of the hydrogen molecule on the (111) and (100) surfaces have been studied with the model proposed by Panczyk and the grand canonical Monte Carlo simulation method. The equilibrium adsorption isotherms are calculated at five different temperatures ranging from 314 K to 376 K and compared with the experimental equilibrium adsorption isotherms. The effects of temperature and pressure on coverage are also analyzed.
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