2020Unpublished venueOpen access

Beyond the Arrhenius rate law in simulating the shock-driven decomposition of polyimide

Jeffrey H. Peterson, Office of Defense Programs (DP) USDOE National Nuclear Security Administration (NNSA), Joshua D. Coe

Open full text 2 citations

Abstract

Building off of previous work simulating the shock-driven decomposition of polysulfone, we present simulations of the shock-driven decomposition of polyimide. In agreement with the previous work, we find that the Arrhenius rate equation is insufficient for quantitatively reproducing the experimental wave profiles, and we also find that the Arrhenius rate equation cannot reproduce many of the qualitative features of the wave. In light of these results, we examined both an empirical Eyring rate equation as well as the Shock Reactive Flux Method (SRFM) as presented by Valone and found neither to be able to fully capture the quantitative behavior of the measured wave. More specifically, we found that the Eyring equation was only marginally better than an Arrhenius rate law in achieving the very fast reaction rates required to reproduce data at high particle velocities. While the SRFM offered two additional parameters for fitting reaction behavior, we found that the rate law was only able to reproduce the data over a limited range of particle velocities while not being able to reproduce measured shock velocities.

Open-access reader

About this research paper

What this paper is about

Building off of previous work simulating the shock-driven decomposition of polysulfone, we present simulations of the shock-driven decomposition of polyimide. In agreement with the previous work, we find that the Arrhenius rate equation is insufficient for quantitatively reproducing the experimental wave profiles, and we also find that the Arrhenius rate equation cannot reproduce many of the qualitative features of the wave. In light of these results, we examined both an empirical Eyring rate equation as well as the Shock Reactive Flux Method (SRFM) as presented by Valone and found neither to be able to fully capture the quantitative behavior of the measured wave. More specifically, we found that the Eyring equation was only marginally better than an Arrhenius rate law in achieving the very fast reaction rates required to reproduce data at high particle velocities. While the SRFM offered two additional parameters for fitting reaction behavior, we found that the rate law was only able to reproduce the data over a limited range of particle velocities while not being able to reproduce measured shock velocities.

Why it matters

OpenAlex reports 2 citations for this work. Citation counts describe recorded attention and do not establish research quality.

Key contribution

A contribution statement is not available in the OpenAlex record.

Method / approach

Method details are not available in the OpenAlex metadata.

Main findings

Findings are not separately available in the OpenAlex metadata.

Limitations

Limitations are not available in the OpenAlex metadata.

Applications

Application details are not available in the OpenAlex metadata.

Available abstract

Building off of previous work simulating the shock-driven decomposition of polysulfone, we present simulations of the shock-driven decomposition of polyimide. In agreement with the previous work, we find that the Arrhenius rate equation is insufficient for quantitatively reproducing the experimental wave profiles, and we also find that the Arrhenius rate equation cannot reproduce many of the qualitative features of the wave. In light of these results, we examined both an empirical Eyring rate equation as well as the Shock Reactive Flux Method (SRFM) as presented by Valone and found neither to be able to fully capture the quantitative behavior of the measured wave. More specifically, we found that the Eyring equation was only marginally better than an Arrhenius rate law in achieving the very fast reaction rates required to reproduce data at high particle velocities. While the SRFM offered two additional parameters for fitting reaction behavior, we found that the rate law was only able to reproduce the data over a limited range of particle velocities while not being able to reproduce measured shock velocities.

Key concepts: Arrhenius equation, Shock wave, Rate equation, Shock (circulatory), Work (physics), Thermodynamics, Reaction rate, Decomposition

Related papers

Back to paper searchBrowse research topicsOriginal source
Beyond the Arrhenius rate law in simulating the shock-driven decomposition of polyimide — Research Paper | ScholarLens