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题名: Tight-binding molecular dynamics study of C-60, C-116 and C-120
作者: Cao, ZL ;  Yu, XP ;  Xiang, JB ;  Ding, PZ ;  Han, RS
刊名: MODERN PHYSICS LETTERS B
出版日期: 1996
卷号: 10, 期号:17, 页码:831-838
关键词: SOLID C-60 ;  ELECTRONIC-PROPERTIES ;  AMORPHOUS-CARBON ;  C60 ;  SILICON ;  FILMS
学科分类: Physics
通讯作者: Cao, ZL , BEIJING UNIV,DEPT PHYS,BEIJING 100871,PEOPLES R CHINA.
部门归属: ACAD SINICA,INST THEORET PHYS,BEIJING 100080,PEOPLES R CHINA; JILIN UNIV,INST ATOM & MOL,JILIN 130061,PEOPLES R CHINA
英文摘要: The geometric structures of C-60, C-116 and C-120 in their ground states are obtained by tight-binding dynamic molecular simulation (TBMD). We find that the ground state of C-60 has high symmetry, I-h, but C-116 and C-120 have low symmetry, D-2h. The energy bands and vibrational modes of C-116 and C-120 are complex compared with C-60. Some of them can be easily recognized as C-60 derived and are no longer degenerate but very close, and others are produced by the interaction and relative movement between two C-58 or two C-60.
收录类别: SCI
原文出处: 查看原文
内容类型: 期刊论文
URI标识: http://ir.itp.ac.cn/handle/311006/12606
Appears in Collections:理论物理所1978-2010年知识产出_期刊论文

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Recommended Citation:
Cao, ZL,Yu, XP,Xiang, JB,et al. Tight-binding molecular dynamics study of C-60, C-116 and C-120[J]. MODERN PHYSICS LETTERS B,1996,10(17):831-838.
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