Monte Carlo simulation of two interpenetrating polymer networks: Structure, swelling, and mechanical properties

被引:28
作者
Edgecombe, Samuel [1 ]
Linse, Per [1 ]
机构
[1] Lund Univ, Ctr Chem & Chem Engn, S-22100 Lund, Sweden
关键词
interpenetrating polymer networks; static properties; Monte Carlo simulation;
D O I
10.1016/j.polymer.2008.02.018
中图分类号
O63 [高分子化学(高聚物)];
学科分类号
070305 ; 080501 ; 081704 ;
摘要
The swelling and mechanical properties of various interpenetrating polymer networks (IPNs) were studied. Six networks made from permutations of a moderately crosslinked polyelectrolyte network (ref), a moderately crosslinked neutral polymer network (net1), and a highly crosslinked polyelectrolyte network (net2) were first swollen in water and structural properties such as end-to-end chain lengths and radial distribution functions were compared with the component networks' equilibrium properties. The swelling of composite IPNs was discussed in terms of a balance between the osmotic pressure due to mobile counterions and the restoring force of the network chains, which act in parallel to counteract the osmotic swelling. For the ref-net2 system, the strong stretching of net2 chains increases the network restoring force and the further swelling due to the counterions is suppressed. The swollen networks were then uniaxially stretched, and equilibrium stress-strain plots were obtained up to high extension ratios. The equilibrium volume decreased upon uniaxial extension, and the elastic moduli of IPNs of the A-A type were slightly greater than that of their respective single networks. (C) 2008 Elsevier Ltd. All rights reserved.
引用
收藏
页码:1981 / 1992
页数:12
相关论文
共 25 条
[1]  
Allen M. P., 2017, Computer Simulation of Liquids, DOI [10.1093/oso/9780198803195.001.0001, DOI 10.1093/OSO/9780198803195.001.0001]
[2]   Swelling behaviour of a polyelectrolyte network under load [J].
Budtova, T ;
Suleimenov, I .
POLYMER, 1997, 38 (24) :5947-5952
[3]   Monte Carlo simulations of defect-free cross-linked gels in the presence of salt [J].
Edgecombe, S ;
Schneider, S ;
Linse, P .
MACROMOLECULES, 2004, 37 (26) :10089-10100
[4]   Entanglement effects in defect-free model polymer networks [J].
Everaers, Ralf .
NEW JOURNAL OF PHYSICS, 1999, 1 :12.1-12.54
[5]   Double-network hydrogels with extremely high mechanical strength [J].
Gong, JP ;
Katsuyama, Y ;
Kurokawa, T ;
Osada, Y .
ADVANCED MATERIALS, 2003, 15 (14) :1155-+
[6]   Non-Gaussian elasticity of swollen poly(N-isopropylacrylamide) gels at high charge densities [J].
Gundogan, N ;
Melekaslan, D ;
Okay, O .
EUROPEAN POLYMER JOURNAL, 2003, 39 (11) :2209-2216
[7]   Mechanical and transport properties of the poly(ethylene oxide)-poly(acrylic acid) double network hydrogel from molecular dynamic simulations [J].
Jang, Seung Soon ;
Goddard, William A., III ;
Kalani, M. Yashar S. .
JOURNAL OF PHYSICAL CHEMISTRY B, 2007, 111 (07) :1729-1737
[8]  
KHOKHLOV AR, 1993, RESPONSIVE GELS VOLU, V1, P109
[9]   Negatively charged polyelectrolyte gels as bio-tissue model system and for biomedical application [J].
Kwon, Hyuck Joon ;
Gong, Jian Ping .
CURRENT OPINION IN COLLOID & INTERFACE SCIENCE, 2006, 11 (06) :345-350
[10]  
LINSE P, 2004, MOLSIM 4 07