Prediction of nature of band gap of perovskite oxides (ABO3) using a machine learning approach MN Mattur, N Nagappan, S Rath, T Thomas Journal of Materiomics 8 (5), 937-948, 2022 | 42 | 2022 |
Discovery of direct band gap perovskites for light harvesting by using machine learning S Rath, GS Priyanga, N Nagappan, T Thomas Computational Materials Science 210, 111476, 2022 | 34 | 2022 |
Prediction of crystal structure, phase group, and stability of 2D materials through data science coupled with DFT N Nagappan, GS Priyanga, T Thomas Physica B: Condensed Matter 696, 416638, 2025 | | 2025 |
Trends and insights into alloying elements impact on predicted battery voltage in metal-ion batteries N Nagappan, GS Priyanga, T Thomas Journal of Energy Storage 103, 114412, 2024 | | 2024 |
Selection of solid-state electrolytes for lithium-ion batteries using clustering technique N Nagappan, GR Kandregula, K Ramanujam Journal of Chemical Sciences 136 (2), 38, 2024 | | 2024 |