Theoretical investigations on SiC2 siligraphene as promising metal-free catalyst for oxygen reductio

来源 :第十三届全国计算机化学学会会议 | 被引量 : 0次 | 上传用户：studyrec

【摘要】

：

　　The design and discovery of high-performance metal-free catalytic materials for oxygen reduction reaction(ORR)electrocatalysis is vital for the development

【作者】

：

HuilongDong;BinLin;KeithGilmore;TingjunHou;Shuit-TongLee;YouyongLi;

【机构】

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Institute of Functional Nano & Soft Materials(FUNSOM),Soochow University,Suzhou,Jiangsu 215123

【出处】

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第十三届全国计算机化学学会会议

【发表日期】

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2015年期

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　　The design and discovery of high-performance metal-free catalytic materials for oxygen reduction reaction(ORR)electrocatalysis is vital for the development of fuel cells.By performing density functional theory(DFT)calculations,we investigate the potential applications of SiC2 siligraphene(g-SiC2)as metal-free ORR catalyst.

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