title: Bi2(IO4)(IO3)3: a new potential infrared nonlinear optical material containing [IO4](3-) anion.
abstract: A new potential infrared (IR) nonlinear optical (NLO) material Bi(2)(IO(4))(IO(3))(3) was synthesized by hydrothermal method. Bi(2)(IO(4))(IO(3))(3) crystallizes in the chiral orthorhombic space group P2(1)2(1)2(1) (No. 19) with a = 5.6831(11) Å, b = 12.394(3) Å, and c = 16.849(3) Å. It exhibits a three-dimensional framework through a combination of the IO(3), IO(4), BiO(8), and BiO(9) polyhedra and is the first noncentrosymmetric (NCS) structure containing [IO4](3-) anion. Bi(2)(IO(4))(IO(3))(3) has an IR cutoff wavelength of 12.3 μm and belongs to the type 1 phase-matchable class with a moderately large SHG response of 5 × KDP, which is in good agreement with the theoretical calculations.
authors.affiliation: Key Laboratory of Functional Crystals and Laser Technology, Technical Institute of Physics and Chemistry, Chinese Academy of Sciences, Beijing 100190, PR China.
authors.forename: Zhenbo
authors.initials: Z
authors.lastname: Cao
authors.forename: Yinchao
authors.initials: Y
authors.lastname: Yue
authors.forename: Jiyong
authors.initials: J
authors.lastname: Yao
authors.forename: Zheshuai
authors.initials: Z
authors.lastname: Lin
authors.forename: Ran
authors.initials: R
authors.lastname: He
authors.forename: Zhanggui
authors.initials: Z
authors.lastname: Hu