Shevchenko Vladimir Ya, Madison Alexey E, Mackay Alan L
Grebenshchikov Institute of Silicate Chemistry, Russian Academy of Sciences, nab. Makarova 2, Saint Petersburg 199034, Russia.
Acta Crystallogr A. 2007 Mar;63(Pt 2):172-6. doi: 10.1107/S0108767307002723. Epub 2007 Feb 15.
The general approach for describing and designing complex hierarchical icosahedral structures is discussed. Structural models of icosahedral carbon nanoparticles in which the local arrangement of atoms is virtually identical to that in diamond are derived. It is shown that icosahedral diamond-like particles can be transformed into onion-like shell structures (and vice versa) by the consecutive smoothing (puckering) of atomic networks without disturbance of their topological integrity. The possibility of coherent coexistence of icosahedral diamond-like core with onion shells is shown.
讨论了描述和设计复杂分层二十面体结构的一般方法。推导了二十面体碳纳米颗粒的结构模型,其中原子的局部排列与金刚石中的几乎相同。结果表明,二十面体类金刚石颗粒可以通过原子网络的连续平滑(起皱)转化为洋葱状壳结构(反之亦然),而不会干扰其拓扑完整性。展示了二十面体类金刚石核与洋葱壳相干共存的可能性。