Sanjida Ahmed Saima

Tailoring Mechanical Stability and Electronic Structure in TiNiSn ‐Based Half‐Heusler Alloys via Sn‐Site Doping: A DFT Study

Half‐Heusler compounds are promising quantum materials for thermoelectric applications due to their excellent electronic properties, including semiconductivity, thermoelectricity and topological insulating behavior. However, optimizing their mechanical stability and optical phenomena remains a challenge. This study...