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A New Double Alkali Metal Borate LiRbB8O13 with Large Bandgap and Birefringence
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作者 CHAI Kun HU Shuai-Shuai +3 位作者 HAN Shu-Juan ABUDUKADI Tudi YANG Zhi-Hua PAN Shi-Lie 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2020年第9期1578-1584,1553,共8页
A new double alkali metal borate,LiRbB8O13,has been obtained in the sealed system.Its structure consists of two kinds of independent interpenetrating 3D frameworks composed of the fundamental building block,[B8O16]8–... A new double alkali metal borate,LiRbB8O13,has been obtained in the sealed system.Its structure consists of two kinds of independent interpenetrating 3D frameworks composed of the fundamental building block,[B8O16]8–.It crystallizes in the P21/c space group with a=10.950(6),b=7.689(4),c=11.375(7)?,β=96.653(7)°,V=951.2(9)?3,Z=4,F(000)=736,Dc=2.702 g/cm3,Mr=386.89 andμ=5.289 mm–1.The final R=0.0547 and w R=0.1224.The UV-Vis-NIR diffuse reflectance spectrum,infrared spectrum and the first-principle theoretical studies show that the title compound possesses a short cut-off edge and large birefringence. 展开更多
关键词 double alkali metal BORATE BIREFRINGENCE cut-off edge
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