中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
The collapse of polyethylene rings on an attractive surface

文献类型:期刊论文

作者Hao, Liang; Su, Jia-ye; Guo, Hong-xia
刊名CHINESE JOURNAL OF POLYMER SCIENCE
出版日期2013-08-01
卷号31期号:8页码:1066-1073
关键词Molecule Dynamics Simulations Polyethylene Rings Adsorption Collapse
ISSN号0256-7679
DOI10.1007/s10118-013-1307-7
英文摘要Polymers exhibit extended structures at high temperatures or in good solvents and collapsed configurations at low temperatures or in poor solvents. This fundamental property is crucial to the design of materials, and indeed has been extensively studied in recent years. In this paper, the collapse of polyethylene rings on an attractive surface was investigated by using molecular dynamics simulations. It is found that the collapse of ring chains on the attractive surface is of distinct difference from their free counterparts, where the collapse becomes more continuous and a one-stage instead of two-stage collapse can be identified by the specific heat. Some hairpin-like crystal structures are found at low temperatures, which are induced by the adsorption interaction of polymer-surface. For a given chain length, the results were further compared with those of the adsorbed linear chains. Due to the topological constraint of ring chains, the number of hairpin structures is clearly less than that of the linear chains. These numerical simulations may provide some new insights into the folding of ring polymers under adsorption interactions.
语种英语
WOS记录号WOS:000321070000002
出版者SPRINGER
源URL[http://ir.iccas.ac.cn/handle/121111/54879]  
专题中国科学院化学研究所
通讯作者Su, Jia-ye
作者单位Chinese Acad Sci, Inst Chem, State Key Lab Polymer Phys & Chem, Beijing Natl Lab Mol Sci,Joint Lab Polymer Sci &, Beijing 100190, Peoples R China
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GB/T 7714
Hao, Liang,Su, Jia-ye,Guo, Hong-xia. The collapse of polyethylene rings on an attractive surface[J]. CHINESE JOURNAL OF POLYMER SCIENCE,2013,31(8):1066-1073.
APA Hao, Liang,Su, Jia-ye,&Guo, Hong-xia.(2013).The collapse of polyethylene rings on an attractive surface.CHINESE JOURNAL OF POLYMER SCIENCE,31(8),1066-1073.
MLA Hao, Liang,et al."The collapse of polyethylene rings on an attractive surface".CHINESE JOURNAL OF POLYMER SCIENCE 31.8(2013):1066-1073.

入库方式: OAI收割

来源:化学研究所

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