Jagadish Kumar

collaborators

2 papers

cond-mat.mtrl-sci2025

Unraveling the electronic, vibrational, thermodynamic, optical and piezoelectric properties of LiNbO $_{3}$ , LiTaO $_{3}$ and Li $_{2}$ NbTaO $_{6}$ from first-principles calculations

Debidutta Pradhan, Rojalin Swain, Souvagya Kumar Biswal +1

We have investigated the electronic, vibrational, optical, thermal and piezoelectric properties of LiNbO $_{3}$ , LiTaO $_{3}$ and Li $_{2}$ NbTaO $_{6}$ using the first-principles calculation b…

cond-mat.mtrl-sci2025

Structural, electronic, vibrational, optical, piezoelectric, thermal and thermoelectric properties of BCZT from first-principles calculations

Debidutta Pradhan, Jagadish Kumar

Perovskite material such as BCZT (Ba $_{0.875}$ Ca $_{0.125}$ (Zr $_{0.125}$ Ti $_{0.875}$ )O $_{3}$ ) is well known for its high value of piezoceramic properties and Curie temperature which…

Unraveling the electronic, vibrational, thermodynamic, optical and piezoelectric properties of LiNbO3​, LiTaO3​ and Li2​NbTaO6​ from first-principles calculations

Structural, electronic, vibrational, optical, piezoelectric, thermal and thermoelectric properties of BCZT from first-principles calculations

Unraveling the electronic, vibrational, thermodynamic, optical and piezoelectric properties of LiNbO $_{3}$ , LiTaO $_{3}$ and Li $_{2}$ NbTaO $_{6}$ from first-principles calculations