Browsing Department of Chemistry (MU) by Thesis Advisor "Sewell, Tommy"
Now showing items 1-2 of 2
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Anisotropic shock response of 1,3,5-triamino-2,4,6-trinitrobenzene (TATB)
(University of Missouri--Columbia, 2020)The thermo-mechanical response of shock-induced pore collapse has been studied using non-reactive all-atom molecular dynamics (MD) and Eulerian continuum simulations for the molecular crystal 1,3,5-triamino-2,4,6-trinitrobenzene ... -
Molecular dynamics simulations of shock-induced pore collapse in single crystal [beta]-HMX
(University of Missouri--Columbia, 2023)This thesis presents all-atom classical molecular dynamics (MD) simulations of shock-wave passage across a pore-type defect in single-crystal [beta]-1,3,5,7-tetranitro-1,3,5,7-tetraocane ([beta]-HMX). The purpose of this ...