Advanced materials design drives innovation across the chemical and semiconductor industries, yet conventional computational approaches face limitations in accuracy and scalability when exploring complex molecular and material systems. This challenge centers on the Generative Quantum Eigensolver (GQE), an AI-driven quantum application that combines generative machine learning models with quantum eigensolvers to enable more accurate quantum simulations and efficient exploration of vast materials design spaces. Participants will investigate approaches for applying GQE within a Quantum Materials Informatics platform to improve quantum simulation accuracy for material properties, efficiently generate molecular and structural candidates, and accelerate materials discovery beyond the capabilities of classical simulation methods, including the simulation of extreme ultraviolet semiconductor materials.