.png){kind=icon}
返回
Polymer modeling
.png){kind=icon}
PRE
AI
DOI：10.1016/S1359-0286(01)00026-2.png)
.png){kind=icon}
原文求助.png){kind=icon}
分享.png){kind=icon}
收藏
摘要
En 中文
The modeling of polymers, the most prominent of soft materials, has reached a level of maturity within the last few years, but new advances are being made in several areas of considerable practical importance. New sampling techniques are being developed to accelerate the exploration of configuration space, which has been and continues to be of paramount importance in the determination of the properties of polymeric materials. Simultaneous length and time scale problems are being addressed with new coarse-grained methods, while more traditional methods are being applied to problems of increasing chemical complexity and reality. These several advances are yielding unprecedented insights into the relative importance of intramolecular (manifested in long-range polymeric structure) and intermolecular interactions in determining the properties of materials. (C) 2001 Elsevier Science Ltd. All rights reserved.
Keyword:
MOLECULAR-DYNAMICS SIMULATIONS
MONTE-CARLO SIMULATIONS
FORCE-FIELD
LIQUID-CRYSTAL
PHASE
COPOLYMER
WATER
MELT
期刊
IF:
13.4
论文数:
1.3K
被引数:
5.5K
机构
暂无机构信息
引用论文
Molecular dynamics of a 1,4-polybutadiene melt. Comparison of experiment and simulation.png)
MACROMOLECULES
MACROMOLECULESIF5.2
PREAI
分享收藏A Monte Carlo simulation on the effects of chain end modification on freely standing thin films of amorphous polyethylene meltsMACROMOLECULES
MACROMOLECULESIF5.2
PREAI
分享收藏Atomistically modeling the chemical potential of small molecules in dense polymer microstructures .2. Water sorption by polyamidesMACROMOLECULES
MACROMOLECULESIF5.2
PREAI
分享收藏Molecular dynamics simulations of poly(ethylene oxide)/LiI melts. 2. Dynamic propertiesMACROMOLECULES
MACROMOLECULESIF5.2
PREAI
分享收藏X-ray analysis and molecular modeling of poly(vinyl alcohol)s with different stereoregularitiesMACROMOLECULES
MACROMOLECULESIF5.2
PREAI
分享收藏
查看更多内容