Concepedia

First-principles investigation of Cs2TlGaX6 (X = Cl, F) double perovskites: structural and dynamical stability, elastic properties, and optoelectronic characteristics for applications in semiconductor technology

Nasir Rahman, Mudasser Husain, Younas Ahmad, Ahmed Azzouz‐Rached, Bashar M. Al-khamiseh, Muhammad Asad, Akhlaq Hussain, Rashid Ahmad, Rekab-Djabri Hamza, Vineet Tirth,

Optical and Quantum Electronics · 2024 · 53 citations · 63 references

DOI

Concepts

References

63

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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Accurate and simple analytic representation of the electron-gas correlation energy

John P. Perdew, Yue Wang · Physical review. B, Condensed matter · 1992 · 24.9K citations

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The Compressibility of Media under Extreme Pressures

F. D. Murnaghan · Proceedings of the National Academy of Sciences · 1944 · 8.6K citations · Full text

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Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

Fabien Tran, Peter Blaha · Physical Review Letters · 2009 · 5.9K citations

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WIEN2k: An APW+lo program for calculating the properties of solids

Peter Blaha, Karlheinz Schwarz, Fabien Tran et al. · The Journal of Chemical Physics · 2020 · 2.5K citations · Full text

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