The noncentrosymmetric chain compounds, A3M2AsSe 11 (A = K, Rb, Cs; M = Nb, Ta)

Junghwan Do; Mercouri G. Kanatzidis

doi:10.1016/j.jallcom.2004.03.088

The noncentrosymmetric chain compounds, A₃M₂AsSe ₁₁ (A = K, Rb, Cs; M = Nb, Ta)

Junghwan Do, Mercouri G. Kanatzidis

Northwestern University

Research output: Contribution to journal › Article

8 Citations (Scopus)

Abstract

The noncentrosymmetric niobium and tantalum selenoarsenates, A ₃Nb₂AsSe₁₁ (A=K, Rb, Cs) and K ₃Ta₂AsSe₁₁, were synthesized in a polyselenoarsenate flux. All compounds crystallize in the polar monoclinic space group Cc. The structures are comprised of the same type of infinite chain anions, [M₂Se₂(Se₂)₃(AsSe ₃)]^3- (M=Nb, Ta) separated by alkali metal cations. The As³⁺ centers with nonbonded electron pairs play an important role in stabilizing the noncentrosymmetric structures. UV-Vis spectroscopy, Raman spectroscopy and differential thermal analysis data are reported. The energy gaps of these compounds vary between 1.35 and 1.53eV.

Original language	English
Pages (from-to)	41-49
Number of pages	9
Journal	Journal of Alloys and Compounds
Volume	381
Issue number	1-2
DOIs	https://doi.org/10.1016/j.jallcom.2004.03.088
Publication status	Published - Nov 3 2004

Keywords

Flux synthesis
Non linear optical piezoelectricity
Non-oxide materials

ASJC Scopus subject areas

Mechanics of Materials
Mechanical Engineering
Metals and Alloys
Materials Chemistry

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Do, J., & Kanatzidis, M. G. (2004). The noncentrosymmetric chain compounds, A₃M₂AsSe ₁₁ (A = K, Rb, Cs; M = Nb, Ta). Journal of Alloys and Compounds, 381(1-2), 41-49. https://doi.org/10.1016/j.jallcom.2004.03.088

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AB - The noncentrosymmetric niobium and tantalum selenoarsenates, A 3Nb2AsSe11 (A=K, Rb, Cs) and K 3Ta2AsSe11, were synthesized in a polyselenoarsenate flux. All compounds crystallize in the polar monoclinic space group Cc. The structures are comprised of the same type of infinite chain anions, [M2Se2(Se2)3(AsSe 3)]3- (M=Nb, Ta) separated by alkali metal cations. The As3+ centers with nonbonded electron pairs play an important role in stabilizing the noncentrosymmetric structures. UV-Vis spectroscopy, Raman spectroscopy and differential thermal analysis data are reported. The energy gaps of these compounds vary between 1.35 and 1.53eV.

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