Na3Y3(BO3)4: a new noncentrosymmetric borate with an open-framework structure

Faxian Shan; Lei Kang; Guochun Zhang; Jiyong Yao; Zheshuai Lin; Mingjun Xia; Xinyuan Zhang; Ying Fu; Yicheng Wu

doi:10.1039/C6DT00950F

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Na₃Y₃(BO₃)₄: a new noncentrosymmetric borate with an open-framework structure†

Faxian Shan,^ab Lei Kang,^ab Guochun Zhang,*^a Jiyong Yao,^a Zheshuai Lin,^a Mingjun Xia,^a Xinyuan Zhang,^ab Ying Fu^ab and Yicheng Wu^a

Author affiliations

* Corresponding authors

^a Beijing Center for Crystal R&D, Key Lab of Functional Crystals and Laser Technology of Chinese Academy of Sciences, Technical Institute of Physics and Chemistry, Chinese Academy of Sciences, Beijing 100190, PR China
E-mail: gczhang@mail.ipc.ac.cn

^b University of Chinese Academy of Sciences, Beijing 100049, PR China

Abstract

A new noncentrosymmetric borate, Na₃Y₃(BO₃)₄, was grown in the Na₂O–B₂O₃–NaF flux system. Its open-framework structure features a large hexagonal tunnel (5.92 Å in diameter), which is extremely rare in borates. First-principles calculations on its kinetic stability and optical properties were performed.

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Article information

DOI: https://doi.org/10.1039/C6DT00950F
Article type: Communication
Submitted: 10 Mar 2016
Accepted: 30 Mar 2016
First published: 30 Mar 2016

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Dalton Trans., 2016,45, 7205-7208

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Na₃Y₃(BO₃)₄: a new noncentrosymmetric borate with an open-framework structure

F. Shan, L. Kang, G. Zhang, J. Yao, Z. Lin, M. Xia, X. Zhang, Y. Fu and Y. Wu, Dalton Trans., 2016, 45, 7205 DOI: 10.1039/C6DT00950F

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Dalton Transactions