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Monte Carlo simulation of CO desorption from Fe(100)
Fu, G ; Fu G(傅钢) ; Xia, WS ; Xia WS(夏文生) ; Wan, HL ; Wan HL(万惠霖) ; Zhang, QE ; Zhang QE(张乾二)
1999
关键词Monte Carlo arithmetic bond order conservation-Morse potential(BOC-MP) parallel adsorption
英文摘要On the basis of bridge-like model, temperature-programmed desorption(TPD) spectrum for CO parallel adsorption on Fe(100) surfaces is simulated by Monte Carlo method, which is combined with bond-order conservation-Morse potential(BOC-MP) approach. The surface reaction process and metal-adsorbate (M-A) and adsorbate-adsorbate (A-A) interactions were considered in this simulation. The results are agreement with those observed experimentally, In addition, the effect of CO dissociation and desorption on TPD spectra is also discussed.
语种中文
出版者HIGHER EDUCATION PRESS
内容类型期刊论文
源URL[http://dspace.xmu.edu.cn/handle/2288/13211]  
专题化学化工-已发表论文
推荐引用方式
GB/T 7714
Fu, G,Fu G,Xia, WS,et al. Monte Carlo simulation of CO desorption from Fe(100)[J],1999.
APA Fu, G.,傅钢.,Xia, WS.,夏文生.,Wan, HL.,...&张乾二.(1999).Monte Carlo simulation of CO desorption from Fe(100)..
MLA Fu, G,et al."Monte Carlo simulation of CO desorption from Fe(100)".(1999).
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