Original paper
Carbon fiber synthesis from pitch: Insights from ReaxFF based molecular dynamics simulations
Abstract
Despite the potential to lowering fabrication costs of pitch-based carbon fiber (CF) compared to polyacrylonitrile-based CF, large scale utilization is currently limited by the complexity in manufacturing. This is mainly due to the lack of consistency between the pitch structure/chemistry and CF properties under different processing conditions. Here, we employed full atomistic simulations based on reactive force fields to investigate the...
Paper Details
Title
Carbon fiber synthesis from pitch: Insights from ReaxFF based molecular dynamics simulations
Published Date
May 1, 2021
Journal
Volume
176
Pages
569 - 579
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