(GR12) Predicting Material Properties via Artificial Intelligence

Author: Eric Vertina

Advisor: Professor Oren Mangoubi

Category: Graduate

Abstract: MXenes are a class of 2-D materials that possess a diverse set of properties and have a wide range of applications, including improving solar panels. Physical properties of MXenes need to be better understood and controlled in order to best harness MXenes’ potential sustainability contributions. This research uses an unsupervised VICReg-based graph representation learning model to transform input features from a graph dataset a representation space, which is then fed to downstream models to predict target properties.

UN SDGs: 

SDG 7 – Affordable and Clean Energy

SDG 11 – Sustainable Cities and Communities

SDG 13 – Climate Action

Video Presentation:

Poster Presentation: 

GR12_Predicting Material Properties via AI