TY - JOUR T1 - Simulation of Spherulite Growth Using a Comprehensive Approach to Modeling the First-Order Isotropic/Smectic-A Mesophase Transition AU - Nasser Mohieddin Abukhdeir & Alejandro D. Rey JO - Communications in Computational Physics VL - 2 SP - 301 EP - 316 PY - 2010 DA - 2010/02 SN - 7 DO - http://doi.org/10.4208/cicp.2009.08.201 UR - https://global-sci.org/intro/article_detail/cicp/7630.html KW - AB -

A comprehensive modeling and simulation study of the first-order isotropic/smectic-A transition is presented and applied to phase diagram computation and two-dimensional spherulite growth. An approach based on nonlinear optimization, that incorporates experimental data (from 12CB, dodecyl-cyanobiphenyl), is used to determine physically realistic model parameters. These parameters are then used in conjunction with an optimized phase diagram computation method. Additionally, a time-dependent formulation is presented and applied to the study of two-dimensional smectic-A spherulite growth. These results show the growth kinetics and defect dynamics of nanoscale smectic-A spherulite growth in an isotropic phase with an initially radial layer configuration.