First-Principles Design of Hydrogen Dissociation Catalysts Based on Isoelectronic Metal Solid Solutions.

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第一作者： Dong-Hwa,Seo

第一单位： †Department of Materials Science and Engineering, Research Institute of Advanced Materials (RIAM), Seoul National University, 1 Gwanak-ro, Gwanak-gu, Seoul 151-742, Republic of Korea.

作者： Dong-Hwa,Seo ^[1] ; Hyeyoung,Shin ^[2] ; Kisuk,Kang ^[1] ; Hyungjun,Kim ^[2] ; Sang Soo,Han ^[3]

作者单位： †Department of Materials Science and Engineering, Research Institute of Advanced Materials (RIAM), Seoul National University, 1 Gwanak-ro, Gwanak-gu, Seoul 151-742, Republic of Korea. ^[1] ‡Graduate School of Energy, Environment, Water, and Sustainability (EEWS), Korea Advanced Institute of Science and Technology (KAIST), Yuseong-gu, Daejeon 305-701, Republic of Korea. ^[2] §Center for Computational Science, Korea Institute of Science and Technology (KIST), Seoul 136-791, Republic of Korea. ^[3]

关键词 IrAu alloy RhAg alloy catalyst electronic structure hydrogen dissociation hydrogen storage

DOI 10.1021/jz500496e

PMID 26273859

发布时间 2015-08-15

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