The structure of (C-60)(N) clusters

被引:58
|
作者
Doye, JPK
Wales, DJ
机构
[1] University Chemical Laboratory, Cambridge CB2 1EW, Lensfield Road
基金
英国工程与自然科学研究理事会;
关键词
D O I
10.1016/0009-2614(96)01039-1
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We present likely candidates for the lowest energy minima of (C-60)(N) clusters with N less than or equal to 80 modelled by the Girifalco potential. For N > 13 the clusters exhibit decahedral and close-packed structures, rather than icosahedral. This is a consequence of the short range of attraction of the C-60 intermolecular potential relative to the equilibrium pair separation.
引用
收藏
页码:167 / 174
页数:8
相关论文
共 50 条
  • [1] Polymerized C-60 clusters
    Tast, F
    Malinowski, N
    Billas, IML
    Heinebrodt, M
    Branz, W
    Martin, TP
    JOURNAL OF CHEMICAL PHYSICS, 1997, 107 (17): : 6980 - 6985
  • [2] ELECTRONIC-STRUCTURE OF NEUTRAL AND CHARGED C-60 CLUSTERS
    DECOULON, V
    MARTINS, JL
    REUSE, F
    PHYSICAL REVIEW B, 1992, 45 (23): : 13671 - 13676
  • [3] NUCLEATION OF C-60 CLUSTERS - REPLY
    CHELIKOWSKY, JR
    PHYSICAL REVIEW LETTERS, 1992, 69 (02) : 388 - 388
  • [4] On sodium clusters in C-60 fullerides
    Apostol, M
    Rachdi, F
    Goze, C
    Hajji, L
    CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1997, 75 (01): : 77 - 82
  • [5] NUCLEATION OF C-60 CLUSTERS - COMMENT
    FORD, IJ
    CLEMENT, CF
    PHYSICAL REVIEW LETTERS, 1992, 69 (02) : 387 - 387
  • [7] FRAGMENTATION OF C-60 AND C-70 CLUSTERS
    KIM, EJ
    LEE, YH
    LEE, JY
    PHYSICAL REVIEW B, 1993, 48 (24): : 18230 - 18234
  • [8] The structures of small clusters of C-60 molecules
    Rey, C
    GarciaRodeja, J
    Gallego, LJ
    ZEITSCHRIFT FUR PHYSIK D-ATOMS MOLECULES AND CLUSTERS, 1997, 40 (1-4): : 395 - 398
  • [9] COLLECTIVE ELECTRONIC EXCITATIONS IN C-60 CLUSTERS
    BULGAC, A
    JU, NJ
    PHYSICAL REVIEW B, 1992, 46 (07): : 4297 - 4300
  • [10] C-60 CLUSTERS FORM IN A VARIETY OF GEOMETRIES
    不详
    CHEMICAL & ENGINEERING NEWS, 1993, 71 (20) : 32 - 32