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Publications
Article
Computational screening for novel solid-state electrolytes in Li3MX6 composition
2026
495-504
Article
Computational Discovery of Li6PO5I: An Oxide Argyrodite for Solid-State Electrolytes
2026
1159–1167
Article
Accelerated composition optimization of hybrid perovskites via data-driven materials design, DFT calculations and synthesis
2025
114902
Article
Gas sensing properties of two dimensional tin oxides: A DFT study
2024
160814