The stability, frontier orbitals, bond character, and static linear polarizability of the fluorinated fullerene H20@C80F60
- ISSN号：1674-1056
- 期刊名称：《中国物理B：英文版》
- 时间：0
- 分类：O635.1[理学—高分子化学;理学—化学] TG174.42[金属学及工艺—金属表面处理;金属学及工艺—金属学]
- 作者机构：[1]Department of Applied Physics, Hohai University, Nanjing 210098, China, [2]Department of Applied Physics, Nanjing University of Science and Technology, Nanjing 210094, China
- 相关基金：Project supported by the Research Starting Foundation of Hohai University （Grant No. 2084/40801130）, the Natural Science Foundation of Hohai University （Grant Nos. 2008431211 and 2008430311）, the Excellent Innovation Personal Support Plan of Hohai University, the Basic Scientific Research Foundation of National Central, and the Special Foundation of the Natural Natural Science （Grant No. 10947132）.
关键词：
线性极化, 稳定, 债券, 静态, 轨道, 性质, 富勒烯, 氟化, C80, H20@C80H60, H20@C80F60, density functional theory
中文摘要：
CoHesponding author．E-mail：tcmnj@163．com
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