用自洽场理论和蒙特卡罗模拟研究强不对称A-B-A三嵌段共聚物熔体的双自组装

computational methods in science and technology Pub Date : 2018-01-01 DOI:10.12921/cmst.2018.0000059

M. Dzięcielski, S. Wołoszczuk, M. Banaszak

{"title":"用自洽场理论和蒙特卡罗模拟研究强不对称A-B-A三嵌段共聚物熔体的双自组装","authors":"M. Dzięcielski, S. Wołoszczuk, M. Banaszak","doi":"10.12921/cmst.2018.0000059","DOIUrl":null,"url":null,"abstract":"Using the Self-Consistent Field Theory (SCFT) we study the dual self-assembly of ABA triblock copolymers melts and compare the numerical results with those obtained by the lattice Monte Carlo simulations. While the results are qualitatively similar for both methods, the simulation times are significantly shorter for the SCFT calculations than those for the corresponding Monte Carlo simulations.","PeriodicalId":10561,"journal":{"name":"computational methods in science and technology","volume":"1 1","pages":"227-234"},"PeriodicalIF":0.0000,"publicationDate":"2018-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Dual Self-Assembly in Strongly Asymmetric A-B-A Triblock Copolymer Melts Studied by Self-Consistent Field Theory and Monte Carlo Simulations\",\"authors\":\"M. Dzięcielski, S. Wołoszczuk, M. Banaszak\",\"doi\":\"10.12921/cmst.2018.0000059\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Using the Self-Consistent Field Theory (SCFT) we study the dual self-assembly of ABA triblock copolymers melts and compare the numerical results with those obtained by the lattice Monte Carlo simulations. While the results are qualitatively similar for both methods, the simulation times are significantly shorter for the SCFT calculations than those for the corresponding Monte Carlo simulations.\",\"PeriodicalId\":10561,\"journal\":{\"name\":\"computational methods in science and technology\",\"volume\":\"1 1\",\"pages\":\"227-234\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2018-01-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"computational methods in science and technology\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.12921/cmst.2018.0000059\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"computational methods in science and technology","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.12921/cmst.2018.0000059","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}

引用次数: 0

摘要

利用自洽场理论(SCFT)研究了ABA三嵌段共聚物熔体的双自组装过程，并与晶格蒙特卡罗模拟结果进行了比较。虽然两种方法的结果在质量上是相似的，但SCFT计算的模拟时间明显短于相应的蒙特卡罗模拟。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

查看原文

微信好友朋友圈 QQ好友复制链接

本刊更多论文

Dual Self-Assembly in Strongly Asymmetric A-B-A Triblock Copolymer Melts Studied by Self-Consistent Field Theory and Monte Carlo Simulations

Using the Self-Consistent Field Theory (SCFT) we study the dual self-assembly of ABA triblock copolymers melts and compare the numerical results with those obtained by the lattice Monte Carlo simulations. While the results are qualitatively similar for both methods, the simulation times are significantly shorter for the SCFT calculations than those for the corresponding Monte Carlo simulations.

求助全文

通过发布文献求助，成功后即可免费获取论文全文。去求助

来源期刊

computational methods in science and technology

自引率

0.00%

发文量