DFT study on the adsorption of diethyl, ethyl methyl, and dimethyl ethers on the surface of gallium doped graphene

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• 作者：Ali Shokuhi Rad^a ; ^{a.shokuhi@gmail.com} ; ^{a.shokuhi@qaemiau.ac.ir} ; Emad Sani^a ; Ehsan Binaeian^a ; Majid Peyravi^b ; Mohsen Jahanshahi^b
• 关键词：Gallium doped graphene ; Density functional theory ; Ether ; Semiconductor ; Nanostructure adsorbent
• 刊名：Applied Surface Science
• 出版年：2017
• 出版时间：15 April 2017
• 年：2017
• 卷：401
• 期：Complete
• 页码：156-161
• 全文大小：1327 K
• 卷排序：401

文摘

Adsorption of three ether molecules on the surface of Ga-doped graphene has been investigated. High degree of adsorption for all analytes is found. Ga-doped graphene shows p-type semiconductor property upon adsorption of ether molecules.