Wednesday, March 8, 2023
3:00PM - 3:36PM
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Q20.00001: Supervised and Unsupervised Learning in Atomistic Simulations of Materials Under Reactive Conditions
Invited Speaker:
Nir Goldman
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Wednesday, March 8, 2023
3:36PM - 3:48PM
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Q20.00002: Multiscale Strategy for Predicting Radiation Chemistry in Polymers
Matthew P Kroonblawd, Anthony Yoshimura, Nir Goldman, Amitesh Maiti, James P Lewicki, Andrew P Saab
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Wednesday, March 8, 2023
3:48PM - 4:00PM
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Q20.00003: Ab Initio Study of the Origin of Life in the Upper Mantle of Earth
Tao Li, Ding Pan
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Wednesday, March 8, 2023
4:00PM - 4:12PM
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Q20.00004: High explosive shock initiation model with shear band reactivity and carbon condensation effects
Joel G Christenson, Matthew P Kroonblawd, Laurence E Fried
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Wednesday, March 8, 2023
4:12PM - 4:24PM
Author not Attending
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Q20.00005: Microscopic mechanism of nanoscale shear bands in an energetic molecular crystal (α-RDX): a first-order structural phase transition
Sergei Izvekov, Betsy M Rice
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Wednesday, March 8, 2023
4:24PM - 4:36PM
Author not Attending
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Q20.00006: Large scale atomistic simulations on polymer-bonded energetic materials
Chunyu Li
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Wednesday, March 8, 2023
4:36PM - 4:48PM
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Q20.00007: Modeling Carbon Condensation in Detonation of High Explosives: A Tale of Two Approximations
Kirill A Velizhanin, Erik B Watkins
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Wednesday, March 8, 2023
4:48PM - 5:00PM
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Q20.00008: Ab-initio Dynamics of the sp2/sp3 Structural Evolution in Amorphous Carbon (a-C) and (a-CN)
Brad Steele, Sorin Bastea, I-Feng Kuo
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Wednesday, March 8, 2023
5:00PM - 5:12PM
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Q20.00009: Efficiency of Energy Localization in Hotspot Formation for Complex Pore Collapse Mechanisms
Brenden W Hamilton, Timothy C Germann
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Wednesday, March 8, 2023
5:12PM - 5:24PM
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Q20.00010: The speciation of Platinum and Palladium in aqueous carbonates
Thi Lien Le, Giulia Galli
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Wednesday, March 8, 2023
5:24PM - 5:36PM
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Q20.00011: Effects of Chain Length on the Dynamics and Structure of a Model Polyimide Under Uniaxial Loading
Nicholas T Liesen, Matthew P Kroonblawd, Amitesh Maiti, Christy Fox, Graham Kosiba, Richard H Gee
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Wednesday, March 8, 2023
5:36PM - 5:48PM
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Q20.00012: Pressure dependence of sound velocity, equation of state, and structure of vitons
Charles M Zoller, Jonathan K Simon, Rostislav Hrubiak, Curtis Kenney-Benson, Muhtar Ahart, Russell J Hemley
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