First-Principles Calculations to Investigate Structural, Electronic, Optical and Magnetic Properties of Pyrochlore Oxides Eu<sub>2</sub>Tm<sub>2</sub>O<sub>7</sub> (Tm = Hf, Sn, Zr) for Energy Applications

First-Principles Calculations to Investigate Structural, Electronic, Optical and Magnetic Properties of Pyrochlore Oxides Eu<sub>2</sub>Tm<sub>2</sub>O<sub>7</sub> (Tm = Hf, Sn, Zr) for Energy Applications

Three newly designed pyrochlore oxides, Eu<sub>2</sub>Tm<sub>2</sub>O<sub>7</sub> (Tm = Hf, Sn, Zr), are analyzed for their magnetic, optical and electronic properties using ab-initio calculations within the context of density functional theory (DFT). We can refer...

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Bibliographic Details
Main Authors: Zeesham Abbas, Adeela Naz, Sajjad Hussain, Shabbir Muhammad, H. Algarni, Ahsan Ali, Jongwan Jung
Format: Article
Language:English
Published: MDPI AG 2023-04-01
Series:Inorganics
Subjects:
pyrochlore oxides
optoelectronic properties
magnetic properties
DFT
first-principles
solar cell
Online Access:https://www.mdpi.com/2304-6740/11/5/193

Internet

https://www.mdpi.com/2304-6740/11/5/193

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