Crystallization and arrest mechanisms of model colloids

被引:25
作者
Haxton, Thomas K. [1 ]
Hedges, Lester O. [1 ,2 ]
Whitelam, Stephen [1 ]
机构
[1] Univ Calif Berkeley, Lawrence Berkeley Natl Lab, Mol Foundry, Berkeley, CA 94720 USA
[2] Univ Bath, Dept Phys, Bath BA2 7AY, Avon, England
关键词
PROTEIN CRYSTAL NUCLEATION; MOLECULAR-DYNAMICS; PHASE-SEPARATION; DESIGN RULES; KINETICS; SIMULATIONS; TRANSITION; EVOLUTION; PATHWAYS; BEHAVIOR;
D O I
10.1039/c5sm01833a
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 performed dynamic simulations of spheres with short-range attractive interactions for many values of interaction strength and range. Fast crystallization occurs in a localized region of this parameter space, but the character of crystallization pathways is not uniform within this region. Pathways range from one-step, in which a crystal nucleates directly from a gas, to two-step, in which substantial liquid-like clusters form and only subsequently become crystalline. Crystallization can fail because of slow nucleation from either gas or liquid, or because of dynamic arrest caused by strong interactions. Arrested states are characterized by the formation of networks of face-sharing tetrahedra that can be detected by a local common neighbor analysis.
引用
收藏
页码:9307 / 9320
页数:14
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