{"title":"两相三元流体中液滴生长和沉积的大势相场模拟","authors":"W. Verdier, A. Cartalade, M. Plapp","doi":"10.1088/1361-651x/ad627e","DOIUrl":null,"url":null,"abstract":"\n A methodology is built to model and simulate the dynamics of domain coarsening of a two-phase ternary liquid with an arbitrary phase diagram. High numerical performance is obtained through the use of the phase field-method for interface capturing, a lattice Boltzmann method numerical scheme for all the model equations, and a portable, parallel simulation code running on multiple GPUs. The model is benchmarked against an analytic solution for a ternary diffusion couple. It also reproduces the well-known power law for droplet coarsening during Ostwald ripening without fluid flow. Large-scale simulations with flow illustrate the effects of momentum transport and buoyancy, as well as droplet coalescence and sedimentation.","PeriodicalId":1,"journal":{"name":"Accounts of Chemical Research","volume":"6 2","pages":""},"PeriodicalIF":17.7000,"publicationDate":"2024-07-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Grand-potential phase field simulations of droplet growth and sedimentation in a two-phase ternary fluid\",\"authors\":\"W. Verdier, A. Cartalade, M. Plapp\",\"doi\":\"10.1088/1361-651x/ad627e\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"\\n A methodology is built to model and simulate the dynamics of domain coarsening of a two-phase ternary liquid with an arbitrary phase diagram. High numerical performance is obtained through the use of the phase field-method for interface capturing, a lattice Boltzmann method numerical scheme for all the model equations, and a portable, parallel simulation code running on multiple GPUs. The model is benchmarked against an analytic solution for a ternary diffusion couple. It also reproduces the well-known power law for droplet coarsening during Ostwald ripening without fluid flow. Large-scale simulations with flow illustrate the effects of momentum transport and buoyancy, as well as droplet coalescence and sedimentation.\",\"PeriodicalId\":1,\"journal\":{\"name\":\"Accounts of Chemical Research\",\"volume\":\"6 2\",\"pages\":\"\"},\"PeriodicalIF\":17.7000,\"publicationDate\":\"2024-07-12\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Accounts of Chemical Research\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://doi.org/10.1088/1361-651x/ad627e\",\"RegionNum\":1,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Accounts of Chemical Research","FirstCategoryId":"88","ListUrlMain":"https://doi.org/10.1088/1361-651x/ad627e","RegionNum":1,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
Grand-potential phase field simulations of droplet growth and sedimentation in a two-phase ternary fluid
A methodology is built to model and simulate the dynamics of domain coarsening of a two-phase ternary liquid with an arbitrary phase diagram. High numerical performance is obtained through the use of the phase field-method for interface capturing, a lattice Boltzmann method numerical scheme for all the model equations, and a portable, parallel simulation code running on multiple GPUs. The model is benchmarked against an analytic solution for a ternary diffusion couple. It also reproduces the well-known power law for droplet coarsening during Ostwald ripening without fluid flow. Large-scale simulations with flow illustrate the effects of momentum transport and buoyancy, as well as droplet coalescence and sedimentation.
期刊介绍:
Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance.
Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.