Structure of endohedral dimetallofullerene Sc-2@C-84

被引:130
作者
Takata, M
Nishibori, E
Umeda, B
Sakata, M
Yamamoto, E
Shinohara, H
机构
[1] NAGOYA UNIV,DEPT APPL PHYS,NAGOYA,AICHI 46401,JAPAN
[2] NAGOYA UNIV,DEPT CHEM,NAGOYA,AICHI 46401,JAPAN
关键词
D O I
10.1103/PhysRevLett.78.3330
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
The endohedral nature of dimetallfullerene Sc-2@C-84 is determined for the first time by a method which is a combination of the maximum entropy method (MEM) and the Rietveld refinement from synchrotron Powder diffraction data, The obtained. MEM charge density clearly shows the D-2d-symmetry cage structure, indicating the rotation of SC2@C-84 molecules in. solid stale: is almost quenched even at room temperature. From the MEM charge density, the encapsulated Sc-Sc distance and the nearest Sc-C distance are 3.9(1) and 2.4(1) Angstrom, respectively.
引用
收藏
页码:3330 / 3333
页数:4
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