Theoretical study on the hydration of hydrogen peroxide in terms of ab initio method and atom-bond electronegativity equalization method fused into molecular mechanics | |
Chunyang Yu; Lidong Gong; Zhongzhi Yang | |
刊名 | Frontiers of Chemistry in China |
2011 | |
卷号 | Vol.6 No.4页码:287-299 |
关键词 | ABEEM/MM model ab initio calculation hydrogen peroxide water |
ISSN号 | 1673-3495 |
URL标识 | 查看原文 |
内容类型 | 期刊论文 |
URI标识 | http://www.corc.org.cn/handle/1471x/1857718 |
专题 | 辽宁师范大学 |
作者单位 | School of Chemistry and Chemical Engineering, Liaoning Normal University, Dalian, 116029, China |
推荐引用方式 GB/T 7714 | Chunyang Yu,Lidong Gong,Zhongzhi Yang. Theoretical study on the hydration of hydrogen peroxide in terms of ab initio method and atom-bond electronegativity equalization method fused into molecular mechanics[J]. Frontiers of Chemistry in China,2011,Vol.6 No.4:287-299. |
APA | Chunyang Yu,Lidong Gong,&Zhongzhi Yang.(2011).Theoretical study on the hydration of hydrogen peroxide in terms of ab initio method and atom-bond electronegativity equalization method fused into molecular mechanics.Frontiers of Chemistry in China,Vol.6 No.4,287-299. |
MLA | Chunyang Yu,et al."Theoretical study on the hydration of hydrogen peroxide in terms of ab initio method and atom-bond electronegativity equalization method fused into molecular mechanics".Frontiers of Chemistry in China Vol.6 No.4(2011):287-299. |
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