Filler reinforcement in cross-linked elastomer nanocomposites: insights from fully atomistic molecular dynamics simulation
出版年份 2016 全文链接
标题
Filler reinforcement in cross-linked elastomer nanocomposites: insights from fully atomistic molecular dynamics simulation
作者
关键词
-
出版物
Soft Matter
Volume 12, Issue 24, Pages 5402-5419
出版商
Royal Society of Chemistry (RSC)
发表日期
2016-05-26
DOI
10.1039/c6sm00543h
参考文献
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注意:仅列出部分参考文献,下载原文获取全部文献信息。- Validation of Force Fields of Rubber through Glass-Transition Temperature Calculation by Microsecond Atomic-Scale Molecular Dynamics Simulation
- (2016) Pragati Sharma et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Modeling of Polymer Structure and Conformations in Polymer Nanocomposites from Atomistic to Mesoscale: A Review
- (2016) Argyrios Karatrantos et al. Polymer Reviews
- Mesoscale modelling of environmentally responsive hydrogels: emerging applications
- (2015) Peter D. Yeh et al. CHEMICAL COMMUNICATIONS
- Dielectric α-relaxation of 1,4-polybutadiene confined between graphite walls
- (2015) M. Solar et al. EUROPEAN PHYSICAL JOURNAL E
- Multiscale Modeling of the Polymer–Silica Surface Interaction: From Atomistic to Mesoscopic Simulations
- (2015) G. Maurel et al. Journal of Physical Chemistry C
- Hopping Diffusion of Nanoparticles in Polymer Matrices
- (2015) Li-Heng Cai et al. MACROMOLECULES
- An Eco-Friendly Scheme for the Cross-Linked Polybutadiene Elastomer via Thiol–Ene and Diels–Alder Click Chemistry
- (2015) Jing Bai et al. MACROMOLECULES
- Molecular dynamics simulations of the structural, mechanical and visco-elastic properties of polymer nanocomposites filled with grafted nanoparticles
- (2015) Jianxiang Shen et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Coarse-grained Molecular Dynamics Simulation of the Effects of Strain Rate on Tensile Stress of Cross-Linked Rubber
- (2015) Hiromasa Yagyu SOFT MATERIALS
- Prediction of structural and thermomechanical properties of polymers from multiscale simulations
- (2015) Gaëtan Maurel et al. RSC Advances
- Sawtooth Tensile Response of Model Semiflexible and Block Copolymer Elastomers
- (2014) Bernardo M. Aguilera-Mercado et al. MACROMOLECULES
- Study of the Mechanisms of Filler Reinforcement in Elastomer Nanocomposites
- (2014) Alexey A. Gavrilov et al. MACROMOLECULES
- Thermal Properties and Topology of Epoxy Networks: A Multiscale Simulation Methodology
- (2014) Alexey A. Gavrilov et al. MACROMOLECULES
- Molecular dynamics simulation of the rupture mechanism in nanorod filled polymer nanocomposites
- (2014) Yangyang Gao et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Uniaxial deformation of nanorod filled polymer nanocomposites: a coarse-grained molecular dynamics simulation
- (2014) Yangyang Gao et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Elucidating and tuning the strain-induced non-linear behavior of polymer nanocomposites: a detailed molecular dynamics simulation study
- (2014) Jianxiang Shen et al. Soft Matter
- Detailed simulation of the role of functionalized polymer chains on the structural, dynamic and mechanical properties of polymer nanocomposites
- (2014) Jun Liu et al. Soft Matter
- Mechanical properties of high-performance elastomeric nanocomposites: a sequential mesoscale simulation approach
- (2014) Shengwei Deng et al. RSC Advances
- Predicting mechanical response of crosslinked epoxy using ReaxFF
- (2013) Gregory M. Odegard et al. CHEMICAL PHYSICS LETTERS
- Molecular Dynamics Study of Interface Structure in Composites Comprising Surface-Modified SiO2Nanoparticles and a Polyimide Matrix
- (2013) P. V. Komarov et al. MACROMOLECULAR THEORY AND SIMULATIONS
- Structure of Polymer Layers Grafted to Nanoparticles in Silica–Polystyrene Nanocomposites
- (2013) Georgios G. Vogiatzis et al. MACROMOLECULES
- Theory of Localization and Activated Hopping of Nanoparticles in Cross-Linked Networks and Entangled Polymer Melts
- (2013) Zachary E. Dell et al. MACROMOLECULES
- COMPUTATIONAL SIMULATION OF ELASTOMER NANOCOMPOSITES: CURRENT PROGRESS AND FUTURE CHALLENGES
- (2013) Jun Liu et al. RUBBER CHEMISTRY AND TECHNOLOGY
- MOLECULAR MODELING OF THERMAL AND MECHANICAL PROPERTIES OF ELASTOMERS: A REVIEW
- (2013) Kshitij C. Jha et al. RUBBER CHEMISTRY AND TECHNOLOGY
- Effect of nanotube size on the mechanical properties of elastomeric composites
- (2013) Alexey A. Gavrilov et al. Soft Matter
- Theory and simulation studies of effective interactions, phase behavior and morphology in polymer nanocomposites
- (2013) Venkat Ganesan et al. Soft Matter
- Multiscale Modeling Approach toward the Prediction of Viscoelastic Properties of Polymers
- (2012) G. Maurel et al. Journal of Chemical Theory and Computation
- Implementing molecular dynamics on hybrid high performance computers – Particle–particle particle-mesh
- (2011) W. Michael Brown et al. COMPUTER PHYSICS COMMUNICATIONS
- Nonequilibrium simulations of filled polymer networks: Searching for the origins of reinforcement and nonlinearity
- (2011) Guido Raos et al. JOURNAL OF CHEMICAL PHYSICS
- Directed Assembly of Block Copolymers by Sparsely Patterned Substrates
- (2011) Yury A. Kriksin et al. Journal of Physical Chemistry C
- Predictors of Cavitation in Glassy Polymers under Tensile Strain: A Coarse-Grained Molecular Dynamics Investigation
- (2011) Ali Makke et al. MACROMOLECULAR THEORY AND SIMULATIONS
- Cavitation and Crazing in Rod-Containing Nanocomposites
- (2011) Gregory N. Toepperwein et al. MACROMOLECULES
- Investigation of nanotube length effect on the reinforcement efficiency in carbon nanotube based composites
- (2010) Mahmood M. Shokrieh et al. COMPOSITE STRUCTURES
- Monte Carlo simulations of a coarse grained model for an athermal all-polystyrene nanocomposite system
- (2010) Georgios G. Vogiatzis et al. EUROPEAN POLYMER JOURNAL
- Effective reinforcement of carbon nanotubes in polypropylene matrices
- (2010) H. Deng et al. JOURNAL OF APPLIED POLYMER SCIENCE
- Molecular dynamics simulation for insight into microscopic mechanism of polymer reinforcement
- (2010) Jun Liu et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Molecular dynamics simulations of deformation mechanisms of amorphous polyethylene
- (2010) D. Hossain et al. POLYMER
- Static, rheological and mechanical properties of polymer nanocomposites studied by computer modeling and simulation
- (2009) Jun Liu et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- A Microscopic Model for the Reinforcement and the Nonlinear Behavior of Filled Elastomers and Thermoplastic Elastomers (Payne and Mullins Effects)
- (2008) Samy Merabia et al. MACROMOLECULES
- Long time stress relaxation of amorphous networks under uniaxial tension: The Dynamic Constrained Junction Model
- (2008) Haluk Konyali et al. POLYMER
- Theories and simulations of polymer-based nanocomposites: From chain statistics to reinforcement
- (2008) Giuseppe Allegra et al. PROGRESS IN POLYMER SCIENCE
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