Density functional study on the interaction of hydrogen with Pt 3Ti(111)

Density functional study on the interaction of hydrogen with Pt 3Ti(111)

We investigate the catalytic property of the intermetallic compound Pt 3Ti by studying the interaction of its (111) surface with hydrogen. Based on density functional theory, we obtain the 2-D PES to estimate the barrier for H2 dissociation, and the binding energy of H atom at different sites of the...

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書目詳細資料
Main Authors:	Mozo, Romel, Arboleda, Nelson B., Jr., Dino, Wilson A., Rodulfo, Emmanuel, Kasai, Hideaki
格式:	text
出版:	Animo Repository 2006
主題:	Dissociation Binding energy Density functionals Physics
在線閱讀:	https://animorepository.dlsu.edu.ph/faculty_research/4559
標簽:	添加標簽沒有標簽, 成為第一個標記此記錄!
機構:	De La Salle University

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