Pt3Co高指数晶面氧还原过程的密度泛函理论研究
Oxygen Reduction Reaction on Pt3Co High-index Facets by Density Functional Theory
(a1-a3) Pt3Co(211); (b1-b3) Pt3Co(310); (c1-c3) Pt3Co(331); (d1-d3) Pt3Co(511); (e1-e3) Pt3Co(320); (f1-f3) Pt3Co(332)
Pt3Co高指数晶面氧还原过程的密度泛函理论研究 |
| 刘磊, 郭瑞华, 王丽, 王艳, 张国芳, 关丽丽 |
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Oxygen Reduction Reaction on Pt3Co High-index Facets by Density Functional Theory |
| LIU Lei, GUO Ruihua, WANG Li, WANG Yan, ZHANG Guofang, GUAN Lili |
| 图S8 六个HIFs在边缘、台阶1、台阶2处的ρdos和εd |
| Fig. S8 ρdos and εd for the six HIFs at edge, terrace 1, and terrace 2 (a1-a3) Pt3Co(211); (b1-b3) Pt3Co(310); (c1-c3) Pt3Co(331); (d1-d3) Pt3Co(511); (e1-e3) Pt3Co(320); (f1-f3) Pt3Co(332) |
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