2 papers
cond-mat.mtrl-sci2026
Geometric Percolation Threshold Defines Half-Metallic Window in Vacancy-Doped Titanium disulfides
Shrestha Dutta, Rudra Banerjee
Defect engineering of two-dimensional materials routinely produces local magnetic moments, yet itinerant half-metallic ferromagnetism remains elusive -- experiments frequently yiel…
cond-mat.mtrl-sci2025
Tuning Catalytic Efficiency: Thermodynamic Optimization of Zr-Doped \ce{Ti3C2} and \ce{Ti3CN} MXenes for HER Catalysis
Shrestha Dutta, Rudra Banerjee
Hydrogen production via the Hydrogen Evolution Reaction (HER) is critical for sustainable energy solutions, yet the reliance on expensive platinum (Pt) catalysts limits scalability…