Concepedia

Scrutinize the physical attributes of thermodynamically and elastically stable double perovskite oxides Ba2CdXO6 (X = Mo, U) for optoelectronics, photocatalytic and green technology

Hudabia Murtaza, Junaid Munir, Hamid M. Ghaithan, Qurat Ul Ain, Abdullah Ahmed Ali Ahmed, Saif M. H. Qaid

Computational Materials Science · 2023 · 105 citations · 72 references

DOI

Concepts

References

72

Generalized Gradient Approximation Made Simple

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

, , +16

Special points for Brillouin-zone integrations

Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 70.3K citations

, , +6

First principles phonon calculations in materials science

Atsushi Togo, Isao Tanaka · Scripta Materialia · 2015 · 11.3K citations · Full text

, , +14

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

<i>VESTA</i>: a three-dimensional visualization system for electronic and structural analysis

Koichi Momma, Fujio Izumi · Journal of Applied Crystallography · 2008 · 6.6K citations

, , +17