{"title":"低人工各向异性元胞自动机模型及其在定向凝固细胞-枝晶转变中的应用","authors":"Lei Wei, Xin Lin, Meng Wang, Weidong Huang","doi":"10.1016/j.md.2016.06.001","DOIUrl":null,"url":null,"abstract":"<div><p>A low artificial anisotropy cellular automaton (CA) model is developed for the simulation of microstructure evolution in directional solidification. The CA model’s capture rule was modified by a limited neighbor solid fraction (LNSF) method. Various interface curvature calculation methods have been compared. A modified curvature calculation method based on the variation of the unit vector normal (VUVN) to the solid-liquid interface using volume of fluid (VOF) interpolation technique gets better results. The equilibrium shapes were simulated to quantify the artificial anisotropy, when the interface energy anisotropy coefficient is varied from <em>ε<!--> </em>=<!--> <!-->0.0 to <em>ε<!--> </em>=<!--> <!-->0.05. The low artificial anisotropy CA model is used in the numerical simulation of the cell-to-dendrite transition (CDT) in directional solidification. The influence of physical parameters (<em>Г</em>, <em>D<sub>l</sub></em>, <em>k</em><sub>0</sub>, <em>m<sub>l</sub></em>) on CDT has been investigated. The main finding in this paper is the discovery of the changing behavior of the <em>V</em><sub>cd</sub> when the solute partition coefficient <em>k</em><sub>0</sub> is larger than a critical value. When <em>k</em><sub>0</sub> is less than 0.125, the <em>V</em><sub>cd</sub> follows the Kurz and Fisher criterion <em>V</em><sub>c</sub>/<em>k</em><sub>0</sub>; while when <em>k</em><sub>0</sub> <!-->><!--> <!-->0.125, the <em>V</em><sub>cd</sub> equals to 8<!--> <em>V</em><sub>c</sub>. The experimental data of succinonitrile-acetone (SCN-ace, <em>k</em><sub>0</sub> <!-->=<!--> <!-->0.1) and SCN-camphor (<em>k</em><sub>0</sub> <!-->=<!--> <!-->0.33) support the conclusions from CA simulations.</p></div>","PeriodicalId":100888,"journal":{"name":"Materials Discovery","volume":"3 ","pages":"Pages 17-28"},"PeriodicalIF":0.0000,"publicationDate":"2016-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/j.md.2016.06.001","citationCount":"9","resultStr":"{\"title\":\"Low artificial anisotropy cellular automaton model and its applications to the cell-to-dendrite transition in directional solidification\",\"authors\":\"Lei Wei, Xin Lin, Meng Wang, Weidong Huang\",\"doi\":\"10.1016/j.md.2016.06.001\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>A low artificial anisotropy cellular automaton (CA) model is developed for the simulation of microstructure evolution in directional solidification. The CA model’s capture rule was modified by a limited neighbor solid fraction (LNSF) method. Various interface curvature calculation methods have been compared. A modified curvature calculation method based on the variation of the unit vector normal (VUVN) to the solid-liquid interface using volume of fluid (VOF) interpolation technique gets better results. The equilibrium shapes were simulated to quantify the artificial anisotropy, when the interface energy anisotropy coefficient is varied from <em>ε<!--> </em>=<!--> <!-->0.0 to <em>ε<!--> </em>=<!--> <!-->0.05. The low artificial anisotropy CA model is used in the numerical simulation of the cell-to-dendrite transition (CDT) in directional solidification. The influence of physical parameters (<em>Г</em>, <em>D<sub>l</sub></em>, <em>k</em><sub>0</sub>, <em>m<sub>l</sub></em>) on CDT has been investigated. The main finding in this paper is the discovery of the changing behavior of the <em>V</em><sub>cd</sub> when the solute partition coefficient <em>k</em><sub>0</sub> is larger than a critical value. When <em>k</em><sub>0</sub> is less than 0.125, the <em>V</em><sub>cd</sub> follows the Kurz and Fisher criterion <em>V</em><sub>c</sub>/<em>k</em><sub>0</sub>; while when <em>k</em><sub>0</sub> <!-->><!--> <!-->0.125, the <em>V</em><sub>cd</sub> equals to 8<!--> <em>V</em><sub>c</sub>. The experimental data of succinonitrile-acetone (SCN-ace, <em>k</em><sub>0</sub> <!-->=<!--> <!-->0.1) and SCN-camphor (<em>k</em><sub>0</sub> <!-->=<!--> <!-->0.33) support the conclusions from CA simulations.</p></div>\",\"PeriodicalId\":100888,\"journal\":{\"name\":\"Materials Discovery\",\"volume\":\"3 \",\"pages\":\"Pages 17-28\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2016-03-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://sci-hub-pdf.com/10.1016/j.md.2016.06.001\",\"citationCount\":\"9\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Materials Discovery\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S2352924516300151\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Materials Discovery","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S2352924516300151","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Low artificial anisotropy cellular automaton model and its applications to the cell-to-dendrite transition in directional solidification
A low artificial anisotropy cellular automaton (CA) model is developed for the simulation of microstructure evolution in directional solidification. The CA model’s capture rule was modified by a limited neighbor solid fraction (LNSF) method. Various interface curvature calculation methods have been compared. A modified curvature calculation method based on the variation of the unit vector normal (VUVN) to the solid-liquid interface using volume of fluid (VOF) interpolation technique gets better results. The equilibrium shapes were simulated to quantify the artificial anisotropy, when the interface energy anisotropy coefficient is varied from ε = 0.0 to ε = 0.05. The low artificial anisotropy CA model is used in the numerical simulation of the cell-to-dendrite transition (CDT) in directional solidification. The influence of physical parameters (Г, Dl, k0, ml) on CDT has been investigated. The main finding in this paper is the discovery of the changing behavior of the Vcd when the solute partition coefficient k0 is larger than a critical value. When k0 is less than 0.125, the Vcd follows the Kurz and Fisher criterion Vc/k0; while when k0 > 0.125, the Vcd equals to 8 Vc. The experimental data of succinonitrile-acetone (SCN-ace, k0 = 0.1) and SCN-camphor (k0 = 0.33) support the conclusions from CA simulations.