Chen Zhikang, Zhang Kewang, Zhang Bei, Zhang Jun
School of Physics Science and Technology, Xinjiang University, Urumqi 830046, Xinjiang, People's Republic of China.
Dalton Trans. 2022 Mar 8;51(10):4097-4103. doi: 10.1039/d2dt00009a.
A new borate, NaSrBO, was synthesized by the high-temperature solution method. It exhibits complicated interpenetrating 3D B-O frameworks composed of the functional building block (FBB) [BO]. The UV-vis-NIR diffuse reflectance spectroscopy shows that it has a deep-ultraviolet (DUV) cutoff edge (<200 nm). The relationship between the structures and optical properties was uncovered by theoretical calculations. By the first-principles calculation, the birefringence is estimated to be 0.07 at 1064 nm. The response electron distribution anisotropy (REDA) analysis indicates that the [BO] units contribute mainly to the generation of the moderate birefringence.
通过高温溶液法合成了一种新型硼酸盐NaSrBO。它呈现出由功能构筑单元(FBB)[BO]组成的复杂三维B-O骨架。紫外-可见-近红外漫反射光谱表明它具有深紫外(DUV)截止边(<200nm)。通过理论计算揭示了结构与光学性质之间的关系。通过第一性原理计算,估计在1064nm处双折射为0.07。响应电子分布各向异性(REDA)分析表明,[BO]单元主要对中等双折射的产生有贡献。