TY - GEN
T1 - Molecular dynamics simulations for the analysis of nanoengineered fuzzy fiber composites
AU - Subramanian, Nithya
AU - Chattopadhyay, Aditi
N1 - Funding Information:
This research is supported by the Office of Naval Research (ONR) – United States, Grant No.: N00014-17-1-2037. The program manager is Mr. William Nickerson.
Publisher Copyright:
© 2018, American Institute of Aeronautics and Astronautics Inc, AIAA. All rights reserved.
PY - 2018
Y1 - 2018
N2 - This paper presents the implementation of an atomistic computational framework to investigate a fuzzy fiber nanocomposite architecture. A polymeric functional coating for the carbon fiber surface, which also serves as a substrate for the CNT growth, is explicitly modeled. Additionally, the carbon fiber surface is modeled through irregularly stacked graphene layers with voids. Radially grown CNTs and epoxy resin and hardener molecules are also included at the nanocomposite interface. The epoxy curing simulation is carried out first, followed by virtual deformation of the simulation volume. The tensile and transverse moduli of the fuzzy fiber nanocomposite interface is computed from the virtual deformation simulations. Results indicate that the out-of-plane interface modulus is significantly improved, compared to the traditional fiber/matrix interface by the addition of the polymer coating and radially-grown CNTs. The in-plane transvers modulus also shows improvement and the atomistic modeling framework is able to capture the physical mechanisms that lead to improvement/degradation of material properties.
AB - This paper presents the implementation of an atomistic computational framework to investigate a fuzzy fiber nanocomposite architecture. A polymeric functional coating for the carbon fiber surface, which also serves as a substrate for the CNT growth, is explicitly modeled. Additionally, the carbon fiber surface is modeled through irregularly stacked graphene layers with voids. Radially grown CNTs and epoxy resin and hardener molecules are also included at the nanocomposite interface. The epoxy curing simulation is carried out first, followed by virtual deformation of the simulation volume. The tensile and transverse moduli of the fuzzy fiber nanocomposite interface is computed from the virtual deformation simulations. Results indicate that the out-of-plane interface modulus is significantly improved, compared to the traditional fiber/matrix interface by the addition of the polymer coating and radially-grown CNTs. The in-plane transvers modulus also shows improvement and the atomistic modeling framework is able to capture the physical mechanisms that lead to improvement/degradation of material properties.
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U2 - 10.2514/6.2018-1285
DO - 10.2514/6.2018-1285
M3 - Conference contribution
AN - SCOPUS:85141573058
SN - 9781624105319
T3 - AIAA/AHS Adaptive Structures Conference, 2018
BT - AIAA/AHS Adaptive Structures
PB - American Institute of Aeronautics and Astronautics Inc, AIAA
T2 - AIAA/AHS Adaptive Structures Conference, 2018
Y2 - 8 January 2018 through 12 January 2018
ER -