10 citations · 15 across the 3 of their papers we have counts for
4 papers · 1 filter
Doping Induced Magnetic and Electronic phase Transition in Ferrimagnetic Half-metallic MnAl Compound
Sujoy Datta, Prashant Singh
The future of spintronic and semiconductor applications demands materials with tailored electronic and magnetic properties. This study uses density functional theory to investigate…
Interpretable machine learning-guided design of Fe-based soft magnetic alloys
Aditi Nachnani, Kai K. Li-Caldwell, Saptarshi Biswas +3
We present a machine-learning guided approach to predict saturation magnetization (MS) and coercivity (HC) in Fe-rich soft magnetic alloys, particularly Fe-Si-B systems. ML models…
High temperature oxidation behavior of disordered (Ti0.5Zr0.5)2AlC MAX phase via a Machine Learning-Augmented DFT Approach
P. Singh, D. Sauceda, R. Arroyavea
The Zr-based MAX phases have attracted considerable attention for their outstanding irradiation behavior and high neutron transparency relevant to nuclear power generation technolo…
Metric-driven search for structurally stable inorganic compounds
R. Villarreal, P. Singh, R. Arroyave
We report a facile `metric' for the identification of structurally and dynamically (positive definite phonon structure) stable inorganic compounds. The metric considers charge-imba…