Concepedia

Small band gap Pb-free double perovskites X2NaSbBr6 (X=Na, Li): A study of the stabilities, opto-electronic and thermoelectric aspects from the first-principles approach

Syed Zuhair Abbas Shah, Fawad Khan, Saima Zafar, James Sifuna, Abdelmohsen A. Nassani, Sana Ullah Asif, Zeesham Abbas

Computational Condensed Matter · 2025 · 10 citations · 40 references

DOI

Concepts

References

40

Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text

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QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

Paolo Giannozzi, Stefano Baroni, Nicola Bonini et al. · Journal of Physics Condensed Matter · 2009 · 28.8K citations · Full text

, , +17

Improved adsorption energetics within density-functional theory using revised Perdew-Burke-Ernzerhof functionals

Bjørk Hammer, L. B. Hansen, Jens K. Nørskov · Physical review. B, Condensed matter · 1999 · 8.2K citations · Full text

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BoltzTraP. A code for calculating band-structure dependent quantities

Georg K. H. Madsen, David J. Singh · Computer Physics Communications · 2006 · 6K citations · Full text

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Renewable energy resources: Current status, future prospects and their enabling technology

Omar Ellabban, Haitham Abu‐Rub, Frede Blaabjerg · Renewable and Sustainable Energy Reviews · 2014 · 3K citations

, , +16