TY - JOUR
T1 - Frontal Polymerization of Dicyclopentadiene
T2 - A Numerical Study
AU - Goli, Elyas
AU - Robertson, Ian D.
AU - Geubelle, Philippe H.
AU - Moore, Jeffrey S.
N1 - Funding Information:
This work was supported by the Air Force Office of Scientific Research through Award FA9550-16-1-0017 (Dr. B. “Les” Lee, Program Manager) as part of the Center for Excellence in Self-Healing, Regeneration, and Structural Remodeling.
Publisher Copyright:
© 2018 American Chemical Society.
Copyright:
Copyright 2018 Elsevier B.V., All rights reserved.
PY - 2018/4/26
Y1 - 2018/4/26
N2 - As frontal polymerization is being considered as a faster and more energy efficient manufacturing technique for polymer-matrix fiber-reinforced composites, we perform a finite-element-based numerical study of the initiation and propagation of a polymerization front in dicyclopentadiene (DCPD). The transient thermochemical simulations are complemented by an analytical study of the steady-state propagation of the polymerization front, allowing to draw a direct link between the cure kinetics model and the key characteristics of the front, i.e., front velocity and characteristic length scales. The second part of this study focuses on the prediction of the temperature spike associated with the merger of two polymerization fronts. The thermal peak, which might be detrimental to the properties of the polymerized material, is due to the inability of the heat associated with the highly exothermic reaction to be dissipated when the two fronts merge. The analysis investigates how the amplitude of the thermal spike is affected by the degree of cure at the time of the front merger.
AB - As frontal polymerization is being considered as a faster and more energy efficient manufacturing technique for polymer-matrix fiber-reinforced composites, we perform a finite-element-based numerical study of the initiation and propagation of a polymerization front in dicyclopentadiene (DCPD). The transient thermochemical simulations are complemented by an analytical study of the steady-state propagation of the polymerization front, allowing to draw a direct link between the cure kinetics model and the key characteristics of the front, i.e., front velocity and characteristic length scales. The second part of this study focuses on the prediction of the temperature spike associated with the merger of two polymerization fronts. The thermal peak, which might be detrimental to the properties of the polymerized material, is due to the inability of the heat associated with the highly exothermic reaction to be dissipated when the two fronts merge. The analysis investigates how the amplitude of the thermal spike is affected by the degree of cure at the time of the front merger.
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U2 - 10.1021/acs.jpcb.7b12316
DO - 10.1021/acs.jpcb.7b12316
M3 - Article
C2 - 29664637
AN - SCOPUS:85046012392
SN - 1520-6106
VL - 122
SP - 4583
EP - 4591
JO - Journal of Physical Chemistry B
JF - Journal of Physical Chemistry B
IS - 16
ER -