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Meeting MS&T21: Materials Science & Technology
Symposium Ceramics and Glasses Modeling by Simulations and Machine Learning
Presentation Title Toward Revealing Full Atomic Picture of Nanoindentation Deformation Mechanisms in Li2O-2SiO2 Glass-ceramics
Author(s) Binghui Deng
On-Site Speaker (Planned) Binghui Deng
Abstract Scope Obtaining full understanding of deformation mechanisms in Li2O-2SiO2 glass-ceramics subjected to sharp contact loading is a pressing need for many industrial applications. We herein conduct systematic molecular dynamics simulations to reveal atomic details that are otherwise extremely challenging to probe experimentally. Our study shows that glass-ceramics exhibit a dramatically different plastic deformation map compared to glass, where the nanocrystalline phase dictates the plastic zone shape. Shear flow preferentially nucleates and travels along the interfaces before moving to the surrounding glass and nanocrystals. Dislocations, amorphization zones around the indenter, and shear flow at glass and crystal interfaces help to dissipate contact energy and deconcentrate the deformation, thereby increasing fracture toughness and discouraging the development of catastrophic cracks.
Proceedings Inclusion? Undecided


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Development of a Reactive Force Field (ReaxFF) for Simulation of Polymer-derived Ceramics
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Looking for Order in Disorder: Topological Data Analysis of Glass Structure
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Now On-Demand Only: Information Extraction Pipeline for Glasses: An NLP Based Approach
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Toward Revealing Full Atomic Picture of Nanoindentation Deformation Mechanisms in Li2O-2SiO2 Glass-ceramics

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