Concepedia

Ba<sub>2</sub>M(C<sub>3</sub>N<sub>3</sub>O<sub>3</sub>)<sub>2</sub> (M = Mg, Ca): potential UV birefringent materials with strengthened optical anisotropy originating from the (C<sub>3</sub>N<sub>3</sub>O<sub>3</sub>)<sup>3−</sup> group

Zhuang Li, Fei Liang, Yangwu Guo, Zheshuai Lin, Jiyong Yao, Guochun Zhang, Wenlong Yin, Yicheng Wu, Chuangtian Chen

Journal of Materials Chemistry C · 2018 · 84 citations · 28 references

DOI

Concepts

Abstract

(C<sub>3</sub>N<sub>3</sub>O<sub>3</sub>)<sup>3−</sup> is first proposed to be an excellent birefringent active group and the representative compounds Ba<sub>2</sub>M(C<sub>3</sub>N<sub>3</sub>O<sub>3</sub>)<sub>2</sub> (M = Mg and Ca) are studied in detail.

References

28

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

Phonons and related crystal properties from density-functional perturbation theory

Stefano Baroni, Stefano de Gironcoli, Andrea Dal Corso et al. · Reviews of Modern Physics · 2001 · 9.8K citations · Full text

, , +17

Optimized pseudopotentials

Andrew M. Rappe, Karin M. Rabe, Efthimios Kaxiras et al. · Physical review. B, Condensed matter · 1990 · 2.5K citations

, , +17

Dispersion-equation coefficients for the refractive index and birefringence of calcite and quartz crystals

Gorachand Ghosh · Optics Communications · 1999 · 1.2K citations

, , +15