Concepedia

Exploring the structural, electronic, mechanical, magnetic and optical properties of Cs-based hydride-perovskites CsXH3 (X = Cr, Mn) for hydrogen storage application

Ali Algahtani, Maryam Liaqat, Amina, Muhammad Sajjad, A.M. Quraishi, Nargiza Kamolova, Albandary Almahri, Noureddine Elboughdiri, Anwar ul Haq, Rawaa M. Mohammed,

Inorganic Chemistry Communications · 2024 · 15 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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Accurate Band Gaps of Semiconductors and Insulators with a Semilocal Exchange-Correlation Potential

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

, , +17

Metal hydride materials for solid hydrogen storage: A review☆

Billur Sakintuna, Michael Hirscher · International Journal of Hydrogen Energy · 2007 · 3.6K citations

, , +14

Theoretical predictions of structure and related properties of intermetallics

D. G. Pettifor · Materials Science and Technology · 1992 · 2K citations

, , +17

Efficient linearization of the augmented plane-wave method

Georg K. H. Madsen, Peter Blaha, Karlheinz Schwarz et al. · Physical review. B, Condensed matter · 2001 · 1.1K citations

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