2024

1. A DFT Study of Bandgap Engineering and Tuning of Structural, Electronic, Optical, Mechanical and Transport Properties of Novel [Ba4Sb4Se11]: Sr3+ Selenoantimonate for Optoelectronic and Energy Exploitations

   Journal of Inorganic and Organometallic Polymers and Materials, Vol. 34, Núm. 8, pp. 3689-3706

2. Ab Initio Investigations of Optoelectronic and Transport Behavior of Mn and Eu‐Doped ZnxAxSiGeN4 Using GGA + U Functional: A Study for Optoelectronic Devices

   Journal of Inorganic and Organometallic Polymers and Materials, Vol. 34, Núm. 8, pp. 3384-3400

3. Atomically substitution engineering of europium-based dichalcogenides for enhancing tailored properties and superior applications

   Polyhedron, Vol. 260

4. Exploring the Mechanical, Electronic, and Optical Properties of Gallium Based LmGaAs2 (Lm = In, Eu, Ta) Chalcopyrites Implications for Photovoltaic Applications: An ab Initio DFT Study

   Journal of Inorganic and Organometallic Polymers and Materials, Vol. 34, Núm. 8, pp. 3360-3373

5. Fe and Rh Doping Nanoarchitectonics on Properties of Sr2YGaX2O7 Pyrochlore Oxides with a DFT-Based Spin-Polarized Calculation for Optoelectronic and Thermoelectric Applications

   Journal of Inorganic and Organometallic Polymers and Materials, Vol. 34, Núm. 3, pp. 952-968