Mondal Chandana, Karmakar Smarajit, Sengupta Surajit
Centre for Advanced Materials, Indian Association for the Cultivation of Science , Jadavpur, Kolkata 700032, India.
TIFR Centre for Interdisciplinary Sciences , 21 Brundavan Colony, Narsingi, Hyderabad 500075, India.
J Phys Chem B. 2015 Aug 27;119(34):10902-10. doi: 10.1021/jp512952u. Epub 2015 Apr 3.
We study the phase-ordering dynamics of a 2D model colloidal solid using molecular dynamics simulations. The colloid particles interact with each other with a Hamaker potential modified by the presence of equatorial "patches" of attractive and repulsive regions. The total interaction potential between two such colloids is, therefore, strongly directional and has a 3-fold symmetry. Working in the canonical ensemble, we determine the phase diagram in the density-temperature plane. We obtain three distinct crystalline ground states, viz., a low density honeycomb solid, a rectangular solid at intermediate density, and finally a high-density triangular structure. We show that when cooled rapidly from the liquid phase along iso-chores, the system undergoes a transition to a "strong glass", while slow cooling gives rise to crystalline phases. We claim that geometrical frustration arising from the presence of many competing crystalline ground states causes glassy ordering and dynamics in this solid. Our results may be easily confirmed by suitable experiments on patchy colloids.
我们使用分子动力学模拟研究了二维模型胶体固体的相序动力学。胶体粒子通过由吸引和排斥区域的赤道“斑块”存在而修改的哈马克势相互作用。因此,两个这样的胶体之间的总相互作用势具有很强的方向性并且具有三重对称性。在正则系综中工作,我们确定了密度 - 温度平面中的相图。我们获得了三种不同的晶体基态,即低密度蜂窝状固体、中等密度的矩形固体以及最终的高密度三角形结构。我们表明,当从液相沿着等容线快速冷却时,系统会转变为“强玻璃态”,而缓慢冷却则会产生晶相。我们认为,许多相互竞争的晶体基态的存在所引起的几何挫折导致了这种固体中的玻璃态有序和动力学。我们的结果可以通过对补丁胶体进行适当的实验很容易地得到证实。