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UID:de6f1d6e-87ba-43ea-ac5a-ad6ec3721f74.220707@calendar.missouristate.edu
CREATED:20220411T133656Z
LAST-MODIFIED:20220411T133656Z
LOCATION:Kemper Hall 206
SUMMARY:PAMS Seminar: "Predicting Multiscale Responses of Organic High Exp
 losives Subjected to Thermo-Mechanical Extremes" by Dr. Tommy Sewell
DESCRIPTION:Dr. Tommy SewellDepartment of ChemistryUniversity of Missouri-
 Kansas City\n\n\nAbstract:\n\n\nTo establish the proper set and setting\,
  I will begin with a brief overview of an interdisciplinary AFOSR “MURI” 
 project that I lead which is focused on the development of integrated exp
 erimental and theoretical multiscale methods for understanding and predic
 ting the response of organic composite high explosives to mechanical shoc
 k wave excitation. I will then narrow the focus onto a handful of vignett
 es that address:\n\n\n\naspects of the fundamental nanoscale material mec
 hanics\, transport\, and chemistry that occur in shocked molecular crysta
 ls\, as determined from classical molecular dynamics (MD) simulations\;\n
 some even more fundamental formal developments in the theory of thermal t
 ransport in dielectrics\; \na physics-constrained\, MD-trained neural net
 work approach for obtaining Helmholtz free-energy functionals which captu
 re the single-crystal hyperelastic response in a form suitable for use in
  finite-strain continuum solid-mechanics simulations\; and\nhead-to-head 
 comparisons between large-scale MD and continuum-mechanics predictions of
  shock-induced pore-collapse in molecular crystals\, focusing on the sens
 itivity of the continuum results both to the mesoscale material model for
 m and to the amount of fundamental information from the nanoscale used in
  the parameterization.\n\nIt is not my intent to present the preceding in
  mind-numbing detail. Rather\, I merely seek to convey a sense for the ki
 nds of new knowledge and understanding of the nanoscale physics that we a
 re obtaining and the methods by which they are achieved\; how this fundam
 ental information is being upscaled to the continuum mesoscale\; and perh
 aps a few opinions as regards implications of our findings for future mes
 oscale material modeling of shock waves in complex systems.
X-ALT-DESC;FMTTYPE=text/html:&lt;html&gt;&lt;head&gt;&lt;title&gt;&lt;/title&gt;&lt;/head&gt;&lt;body&gt;&lt;p&gt;&lt;b
 &gt;Dr.&amp;nbsp\;Tommy Sewell&lt;br&gt;&lt;/b&gt;&lt;strong&gt;Department of&amp;nbsp\;Chemistry&lt;br&gt;&lt;
 /strong&gt;&lt;strong&gt;University of Missouri-Kansas City&lt;/strong&gt;&lt;strong&gt;&lt;br&gt;&lt;/
 strong&gt;&lt;/p&gt;\n&lt;p&gt;Abstract:&lt;/p&gt;\n&lt;p&gt;To establish the proper set and setting
 \, I will begin with a brief overview of an interdisciplinary AFOSR “MURI
 ” project that I lead which is focused on the development of integrated e
 xperimental and theoretical multiscale methods for understanding and pred
 icting the response of organic composite high explosives to mechanical sh
 ock wave excitation. I will then narrow the focus onto a handful of vigne
 ttes that address:&lt;/p&gt;\n&lt;ul&gt;\n&lt;li&gt;aspects of the fundamental nanoscale ma
 terial mechanics\, transport\, and chemistry that occur in shocked molecu
 lar crystals\, as determined from classical molecular dynamics (MD) simul
 ations\;&lt;/li&gt;\n&lt;li&gt;some even more fundamental formal developments in the 
 theory of thermal transport in dielectrics\;&amp;nbsp\;&lt;/li&gt;\n&lt;li&gt;a physics-c
 onstrained\, MD-trained neural network approach for obtaining Helmholtz f
 ree-energy functionals which capture the single-crystal hyperelastic resp
 onse in a form suitable for use in finite-strain continuum solid-mechanic
 s simulations\; and&lt;/li&gt;\n&lt;li&gt;head-to-head comparisons between large-scal
 e MD and continuum-mechanics predictions of shock-induced pore-collapse i
 n molecular crystals\, focusing on the sensitivity of the continuum resul
 ts both to the mesoscale material model form and to the amount of fundame
 ntal information from the nanoscale used in the parameterization.&lt;/li&gt;\n&lt;
 /ul&gt;\n&lt;p&gt;It is not my intent to present the preceding in mind-numbing det
 ail. Rather\, I merely seek to convey a sense for the kinds of new knowle
 dge and understanding of the nanoscale physics that we are obtaining and 
 the methods by which they are achieved\; how this fundamental information
  is being upscaled to the continuum mesoscale\; and perhaps a few opinion
 s as regards implications of our findings for future mesoscale material m
 odeling of shock waves in complex systems.&lt;/p&gt;&lt;/body&gt;&lt;/html&gt;
DTSTART;TZID=America/Chicago:20220428T160000
DTEND;TZID=America/Chicago:20220428T170000
SEQUENCE:0
URL:https://physics.missouristate.edu/seminars.htm
CATEGORIES:Public,Alumni,Current Students,Faculty,Future Students,Staff
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