Ab initio study of cyclohexane dehydrogenation on Pt(111)

Ab initio study of cyclohexane dehydrogenation on Pt(111)

We investigate cyclohexane dehydrogenation on Pt(111) by performing total energy calculations based on the density functional theory (DFT). After interacting with the Pt, the Pt draws an H atom from the cyclohexane, and an H-Pt bond is formed. With the C-H bond broken, cyclohexyl intermediate (C 6H1...

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書目詳細資料
Main Authors:	Tsuda, Muneyuki, Diño, Wilson A., Nakanishi, Hiroshi, Watanabe, Susumu, Kasai, Hideaki
格式:	text
出版:	Animo Repository 2005
主題:	Cyclohexane Dehydrogenation Platinum Density functionals Physics
在線閱讀:	https://animorepository.dlsu.edu.ph/faculty_research/4553
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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