Concepedia

First-principles Calculations to Investigate Emerging Double Perovskites K2NaMoX6 (X=Cl, I) Compounds for Magnetic and Optoelectronic Applications

Sheharyar Munir, Mehwish Khalid Butt, Shatha A. Aldaghfag, Misbah Misbah, Muhammad Yaseen, Nasarullah, Mubashir Nazar, H.H. Somaily

Physica B Condensed Matter · 2022 · 31 citations · 67 references

DOI

Concepts

References

67

XCII. Relations between the elastic moduli and the plastic properties of polycrystalline pure metals

S.F. Pugh · The London Edinburgh and Dublin Philosophical Magazine and Journal of Science · 1954 · 8.4K citations

, , +15

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

Necessary and sufficient elastic stability conditions in various crystal systems

Félix Mouhat, François‐Xavier Coudert · Physical Review B · 2014 · 4.8K citations · Full text

, , +17

Dielectric functions and optical parameters of Si, Ge, GaP, GaAs, GaSb, InP, InAs, and InSb from 1.5 to 6.0 eV

D. E. Aspnes, A. A. Studna · Physical review. B, Condensed matter · 1983 · 4K citations

, , +17

WIEN2k: An Augmented Plane Wave Plus Local Orbitals Program for Calculating Crystal Properties

Peter Blaha, Karlheinz Schwarz, Georg K. H. Madsen et al. · 2019 · 3.4K citations

, , +12