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Journal ArticleDOI

Theories and simulations of polymer-based nanocomposites: From chain statistics to reinforcement

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TLDR
A survey of the present understanding of particle-filled polymers is presented in this paper, as obtained from either theoretical or computational approaches, focusing on composites in which the nanoparticles are either spherical or statistically isotropic aggregates and the matrix is a homopolymer melt or a cross-linked elastomer.
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This article is published in Progress in Polymer Science.The article was published on 2008-07-01. It has received 260 citations till now. The article focuses on the topics: Polymer nanocomposite.

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Journal ArticleDOI

Nanocomposites with Polymer Grafted Nanoparticles

TL;DR: In this article, the authors focus on one particular approach to control the spatial distribution of nanoparticles (NPs) in a polymer matrix, and the properties of polymer-grafted NPs.
Journal ArticleDOI

Printable elastic conductors by in situ formation of silver nanoparticles from silver flakes

TL;DR: A printable elastic conductor containing Ag nanoparticles that are formed in situ, solely by mixing micrometre-sized Ag flakes, fluorine rubbers, and surfactant, resulting in a drastic improvement of conductivity is reported.
Journal ArticleDOI

50th Anniversary Perspective: Are Polymer Nanocomposites Practical for Applications?

TL;DR: The field of polymer nanocomposites has been at the forefront of research in the polymer community for the past few decades as mentioned in this paper, which has enabled many niche solutions such as filled rubbers, continuous fiber reinforced thermoset composites, membranes for gas separations, and dielectrics for capacitors and insulation.
Journal ArticleDOI

Nanocomposites: Structure, Phase Behavior, and Properties

TL;DR: This review focuses on recent advances concerning underpinning points and how they affect measurable properties relevant to engineering applications and the role that particle shape plays in affecting dispersion and hence property control.
References
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Book

Computer Simulation of Liquids

TL;DR: In this paper, the gear predictor -corrector is used to calculate forces and torques in a non-equilibrium molecular dynamics simulation using Monte Carlo methods. But it is not suitable for the gear prediction problem.
Book

Intermolecular and surface forces

TL;DR: The forces between atoms and molecules are discussed in detail in this article, including the van der Waals forces between surfaces, and the forces between particles and surfaces, as well as their interactions with other forces.
Book

Theory of simple liquids

TL;DR: In this article, the authors present a mathematical model for time-dependent correlation functions and response functions in liquid solvers, based on statistical mechanics and molecular distribution functions, and show that these functions are related to time correlation functions in Ionic and Ionic liquids.
Journal ArticleDOI

Understanding Molecular Simulation

Daan Frenkel, +1 more
- 01 Oct 2001 - 
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