First-Principles Study on the Three-Dimensional Structure of Graphane

摘要：

　　Four kinds of three-dimensional structure of graphane are investigated using first-principles method.It is found that the energy of four different structures has little difference,so the conclusion can be drawn that the four structures are likely to exist synchronously in experiments.

关键词： First-principles Structure Graphane

作者: Weiwei Ju Hui Wang Tongwei Li Zhenya Fu Qingguo Zhang

作者单位: School of Science, Henan University of Science and Technology, Luoyang 471003, China

会议类型: 国际会议

会议名称: The Sixth China International Conference on High-Performance Ceramics(第六届中国先进陶瓷国际研讨会(CICC-6))

会议地点: 哈尔滨

会议语种:英文

页码: 803-804

在线出版日期: 2009-08-16（万方平台首次上网日期，不代表论文的发表时间）