2 papers
cond-mat.soft2024
Numerical Study of Cleavable Bond-Modified Polyethylene for Circular Polymer Design
Maria Ley-Flores, Archit Chabbi, Riccardo Alessandri +4
There is considerable interest in designing new polymeric materials with built-in mechanisms for recycling. In this work, we present a systematic exploration of several polyethylen…
cond-mat.soft2024
Thermodynamic and Transport Properties of Binary Mixtures of Polyethylene and Higher n-Alkanes from Physics-Informed and Machine-Learned Models
Maria Ley-Flores, Riccardo Alessandri, Sean Najmi +6
The thermodynamics and transport properties of polymeric materials are essential for the design of reactors and for the development of polymer deconstruction processes. Existing pr…