{"title":"统计网络聚合物尺寸的主曲线","authors":"Hidetaka Tobita","doi":"10.1002/mats.202300027","DOIUrl":null,"url":null,"abstract":"<p>The graph diameter <i>D</i> is correlated with the mean-square radius of gyration <i>Rg</i><sup>2</sup> and is a useful measure to design and control the network architecture. The fraction <i>d</i> of segments located in the diameter chain, defined by <i>d</i> = <i>D</i>/<i>n</i><sub>s</sub>, where <i>n</i><sub>s</sub> is the total number of segments in the polymer, is investigated for various statistical network polymers. It is found that the relationship between <i>d</i> and the cycle rank <i>r</i> of the well-developed statistical networks follows a master curve. As a convenient measure to define the well-developed networks, the network maturity index (NMI) is proposed. The random crosslinked networks with NMI > 3 are considered well-developed, but a larger value of NMI is required for the nonrandom, heterogeneous networks. With the help of prior knowledge of the relationship between <i>Rg</i><sup>2</sup> and <i>D</i>, the master curve for the relationship between the contraction factor <i>g</i> and <i>r</i> can also be determined.</p>","PeriodicalId":18157,"journal":{"name":"Macromolecular Theory and Simulations","volume":"32 6","pages":""},"PeriodicalIF":1.8000,"publicationDate":"2023-06-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://onlinelibrary.wiley.com/doi/epdf/10.1002/mats.202300027","citationCount":"0","resultStr":"{\"title\":\"Master Curve for the Dimensions of Statistical Network Polymers\",\"authors\":\"Hidetaka Tobita\",\"doi\":\"10.1002/mats.202300027\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p>The graph diameter <i>D</i> is correlated with the mean-square radius of gyration <i>Rg</i><sup>2</sup> and is a useful measure to design and control the network architecture. The fraction <i>d</i> of segments located in the diameter chain, defined by <i>d</i> = <i>D</i>/<i>n</i><sub>s</sub>, where <i>n</i><sub>s</sub> is the total number of segments in the polymer, is investigated for various statistical network polymers. It is found that the relationship between <i>d</i> and the cycle rank <i>r</i> of the well-developed statistical networks follows a master curve. As a convenient measure to define the well-developed networks, the network maturity index (NMI) is proposed. The random crosslinked networks with NMI > 3 are considered well-developed, but a larger value of NMI is required for the nonrandom, heterogeneous networks. With the help of prior knowledge of the relationship between <i>Rg</i><sup>2</sup> and <i>D</i>, the master curve for the relationship between the contraction factor <i>g</i> and <i>r</i> can also be determined.</p>\",\"PeriodicalId\":18157,\"journal\":{\"name\":\"Macromolecular Theory and Simulations\",\"volume\":\"32 6\",\"pages\":\"\"},\"PeriodicalIF\":1.8000,\"publicationDate\":\"2023-06-28\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://onlinelibrary.wiley.com/doi/epdf/10.1002/mats.202300027\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Macromolecular Theory and Simulations\",\"FirstCategoryId\":\"5\",\"ListUrlMain\":\"https://onlinelibrary.wiley.com/doi/10.1002/mats.202300027\",\"RegionNum\":4,\"RegionCategory\":\"工程技术\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"POLYMER SCIENCE\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Macromolecular Theory and Simulations","FirstCategoryId":"5","ListUrlMain":"https://onlinelibrary.wiley.com/doi/10.1002/mats.202300027","RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"POLYMER SCIENCE","Score":null,"Total":0}
引用次数: 0
摘要
图的直径D与旋转的均方半径Rg2相关,是设计和控制网络结构的有用指标。研究了各种统计网络聚合物中位于直径链上的段的分数d,定义为d = d /ns,其中ns为聚合物中的段总数。研究发现,在发达的统计网络中,d与循环秩r之间的关系遵循一条主曲线。网络成熟度指数(NMI)是一种方便的网络成熟度指标。具有NMI的随机交联网络;3被认为是发达的,但是对于非随机的、异构的网络,需要更大的NMI值。借助Rg2与D之间关系的先验知识,还可以确定收缩因子g与r之间关系的主曲线。
Master Curve for the Dimensions of Statistical Network Polymers
The graph diameter D is correlated with the mean-square radius of gyration Rg2 and is a useful measure to design and control the network architecture. The fraction d of segments located in the diameter chain, defined by d = D/ns, where ns is the total number of segments in the polymer, is investigated for various statistical network polymers. It is found that the relationship between d and the cycle rank r of the well-developed statistical networks follows a master curve. As a convenient measure to define the well-developed networks, the network maturity index (NMI) is proposed. The random crosslinked networks with NMI > 3 are considered well-developed, but a larger value of NMI is required for the nonrandom, heterogeneous networks. With the help of prior knowledge of the relationship between Rg2 and D, the master curve for the relationship between the contraction factor g and r can also be determined.
期刊介绍:
Macromolecular Theory and Simulations is the only high-quality polymer science journal dedicated exclusively to theory and simulations, covering all aspects from macromolecular theory to advanced computer simulation techniques.