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A. Chauhan

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Open access Sep 2026

Physics-Informed Descriptor Engineering and Explainable Machine Learning Reveal the Quantum Mechanical Origins of Electronic Dielectric Response in Oxide Materials

A physics-informed machine-learning model was created to forecast the dielectric constant of oxide materials. The study explores the physicochemical descriptors that govern the response of the materials. A set of 3304 non-metallic oxide compounds was built using the Materials Project database. A comprehensive feature s...

Mega Novita, A. Chauhan, Nancy Agarwal et al. · 0 citations
Review Open access Jul 2026

Comparative Study of Machine Learning Algorithms for Crystal Structure Predictive Modeling of Li-ion Battery Cathodes

This research determines the important parameters to predict the crystal systems (monoclinic, orthorhombic, and triclinic) and evaluates different machine learning algorithms to make the correct prediction.

M. Novita, A. Chauhan, Rizky Muliani Dwi Ujianti et al. · 0 citations

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