3 papers
cond-mat.mtrl-sci2025
Engineering Multifunctional Response in Monolayer Fe3O4 via Zr Adsorption: From Half-Metallicity to Enhanced Piezoelectricity
Sikander Azam, Qaiser Rafiq, Rajwali Khan +1
Two-dimensional (2D) magnetic oxides are increasingly studied for their multifunctional potential in fields like spintronics, optoelectronics, and energy conversion. In this resear…
cond-mat.mtrl-sci2025
Orbital-Engineered Spin Asymmetry and Multifunctionality in Eu-Activated CaAlSiN: A First-Principles Roadmap to Optical-Thermoelectric Fusion
Muhammad Tayyab, Faiq Umar, Sikander Azam +5
Rare-earth-doped nitride phosphors are promising materials for solid-state lighting and photonic applications due to their thermal stability, sharp emission lines, and strong UV-bl…
cond-mat.mtrl-sci2025
Vanadium-Engineered Co2NiSe4 Nanomaterial: Coupled Thermoelectric, Piezoelectric, and Electronic Optimization via DFT+U for Advanced Energy Applications
Ayesha Riaz, Sikander Azam, Qaiser Rafiq +4
To realize the creation of advanced multifunctional materials in energy storage and conversion technologies, the present research evaluates the structural, electronic, magnetic, th…