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5. Effect of the Ni size on CH4/CO2 reforming over Ni/MgO catalyst：A DFT study

Effect of the Ni size on CH4/CO2 reforming over Ni/MgO catalyst：A DFT study

来源 :中国化学工程学报：英文版 | 被引量 : 0次 | 上传用户：babytoto

【摘 要】

：

Carbon deposition is sensitive to the metal particle sizes of supported Ni catalysts in CH_4/CO_2 reforming.To explore the reason of this phenomenon,Ni4,Ni8,and

【作 者】

：

Yunpeng Guo Jie Feng Wenying L 

【机 构】

：

KeyLaboratoryofCoalScienceandTechnologyforMinistryofEducationandShanxiProvince（TaiyuanUniversityofTe

【出 处】

：

中国化学工程学报：英文版

【发表日期】

：

2017年10期

【关键词】

：

NI催化剂 重整 密度泛函理论 电子转移 颗粒尺寸 解离吸附 金属颗粒 MGO Particle size effect Ni/MgO catalyst CH4 

【基金项目】

：

Supported by the National Natural Science Foundation of China（U1361202,51276120）

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Carbon deposition is sensitive to the metal particle sizes of supported Ni catalysts in CH_4/CO_2 reforming.To explore the reason of this phenomenon,Ni4,Ni8,and Ni12 which re flect the different cluster thicknesses supported on the MgO(100) slabs,have bee

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