4 papers · 1 filter
Multi-Fidelity Predictive Model for Shock Response of Energetic Materials Using Conditional U-Net
Brian H. Lee, Chunyu Li, Aidan Pantoya +3
Mapping microstructure to properties is central to materials science. Perhaps most famously, the Hall-Petch relationship relates average grain size to strength. More challenging ha…
Predictive models for strain energy in condensed phase reactions
Baptiste Martin, Shukai Yao, Chunyu Li +3
Molecular modeling of thermally activated chemistry in condensed phases is essential to understand polymerization, depolymerization, and other processing steps of molecular materia…
Spall strength of symmetric tilt grain boundaries in 6H silicon carbide
Chunyu Li, Alejandro Strachan
Characterizing microstructural effects on the dynamical response of materials is challenging due to the extreme conditions and the short timescales involved. For example, little is…
Molecular Modeling of the Microstructure Evolution during the Carbonization of PAN-Based Carbon Fibers
Saaketh Desai, Chunyu Li, Tongtong Shen +1
Development of high strength carbon fibers (CFs) requires an understanding of the relationship between the processing conditions, microstructure and resulting properties. We develo…