Concepedia

The pressure-induced mechanical and optoelectronic behavior of cubic perovskite PbSnO3 via ab-initio investigations

N.A. Noor, Q. Mahmood, Muhammad Rashid, Bakhtiar Ul Haq, A. Laref

Ceramics International · 2018 · 168 citations · 49 references

DOI

Concepts

References

49

Special points for Brillouin-zone integrations

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

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Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces

John P. Perdew, Adrienn Ruzsinszky, Gábor I. Csonka et al. · Physical Review Letters · 2008 · 11.7K citations · Full text

, , +13

Wave-Number-Dependent Dielectric Function of Semiconductors

David R. Penn · Physical Review · 1962 · 2.9K citations

, , +16

Materials Design and Discovery with High-Throughput Density Functional Theory: The Open Quantum Materials Database (OQMD)

James E. Saal, Scott Kirklin, Muratahan Aykol et al. · JOM · 2013 · 2.5K citations

, , +16

Linear optical properties of solids within the full-potential linearized augmented planewave method

Claudia Draxl, Jorge O. Sofo · Computer Physics Communications · 2006 · 1.7K citations

, , +12