Intermediate sp-hybridization for chemical bonds in nonplanar covalent molecules of carbon
文献类型：期刊论文
| 作者 | Cao, ZX |
| 刊名 | CHINESE PHYSICS B
 |
| 出版日期 | 2014 |
| 卷号 | 23期号:6 |
| 关键词 | orbital hybridization representation buckled graphene C60 |
| ISSN号 | 1674-1056 |
| 通讯作者 | Cao, ZX (reprint author), Chinese Acad Sci, Inst Phys, Beijing 100190, Peoples R China. |
| 中文摘要 | General representations for symmetrical and asymmetrical intermediate sp-hybridization are provided, with which the development of electronic structure in C-3v-symmetrical C2H6 and the bonding configuration in C-60 have been analyzed as an example. The spherical structure of C-60 does not necessarily require the fourth hybrid, h(4), to lie along the radial direction. Rather, h(4) runs at an angle of 3.83 degrees from the radius, in the plane bisecting a pentagon, to achieve maximum overlap with adjacent h(4)-hybrids. By virtue of these representations, a number of properties of covalent molecules and solids can be conveniently calculated. This work might be particularly helpful for the study of C-C bonding in curved structures of carbon, such as fullerenes, carbon nanotubes, and buckled graphene. |
| 语种 | 英语 |
| 公开日期 | 2015-04-14 |
| 源URL | [http://ir.iphy.ac.cn/handle/311004/58995]  |
| 专题 | 物理研究所_物理所公开发表论文_物理所公开发表论文_期刊论文 |
| 推荐引用方式 GB/T 7714 | Cao, ZX. Intermediate sp-hybridization for chemical bonds in nonplanar covalent molecules of carbon[J]. CHINESE PHYSICS B,2014,23(6). |
| APA | Cao, ZX.(2014).Intermediate sp-hybridization for chemical bonds in nonplanar covalent molecules of carbon.CHINESE PHYSICS B,23(6). |
| MLA | Cao, ZX."Intermediate sp-hybridization for chemical bonds in nonplanar covalent molecules of carbon".CHINESE PHYSICS B 23.6(2014). |
入库方式： OAI收割
来源：物理研究所
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