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Mechanical Engineering

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Clemson University

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Nanocomposites

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Effects Of Polymer Side-Group Size On Interfacial Mechanics Of Graphene-Polymer Nanocomposites, Grace Brokaw Dec 2022

Effects Of Polymer Side-Group Size On Interfacial Mechanics Of Graphene-Polymer Nanocomposites, Grace Brokaw

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Graphene-reinforced polymer nanocomposites possess excellent mechanical, thermal, and electrical properties, which make them promising candidates for various applications. Favorable interfacial interactions and mechanics between graphene sheets and polymer matrices are often essential to achieve superior mechanical properties. Nevertheless, it remains largely elusive how molecular features of polymer systems, particularly the side-group size of polymer chains, affect the interfacial mechanics between graphene sheets and polymer matrices, primarily due to challenges in well controlling these features in experiments. On the other hand, exploring their roles in the mechanical properties of graphene-polymer nanocomposites is very expensive to study with all-atomistic molecular dynamics (MD) …


Phonon Transport Analysis Of Semiconductor Nanocomposites Using Monte Carlo Simulations, Mayank Malladi Dec 2013

Phonon Transport Analysis Of Semiconductor Nanocomposites Using Monte Carlo Simulations, Mayank Malladi

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Nanocomposites are composite materials which incorporate nanosized particles, platelets or fibers. The addition of nanosized phases into the bulk matrix can lead to significantly different material properties compared to their macrocomposite counterparts. For nanocomposites, thermal conductivity is one of the most important physical properties. Manipulation and control of thermal conductivity in nanocomposites have impacted a variety of applications. In particular, it has been shown that the phonon thermal conductivity can be reduced significantly in nanocomposites due to the increase in phonon interface scattering while the electrical conductivity can be maintained. This extraordinary property of nanocomposites has been used to enhance …


Molecular Dynamics Study Of Particle Impact Induced Bond Breaking Of Single-Walled Carbon Nanotubes And Quality Factors Of Nanocomposite Structures, Puroorava Annapaneni Aug 2011

Molecular Dynamics Study Of Particle Impact Induced Bond Breaking Of Single-Walled Carbon Nanotubes And Quality Factors Of Nanocomposite Structures, Puroorava Annapaneni

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Part A
Injection of particles to the side wall of single-walled carbon nanotubes (SWCNT) has been employed for doping and storage of particles on SWCNTs. In addition, particle bombardment can be used to cut and modify graphene structures. While the collision of hydrogen atoms with SWCNTs has been extensively studied, collision dynamic behavior of heavy particles with SWCNTs has not been well understood. To facilitate a better understanding of the particle-SWCNT collision process, in this work, we study the impact of five noble gas atoms (He, Ne, Ar, Kr, Xe) with SWCNTs and investigate particle impact induced CNT bond breaking …