Effect of the [Ba2BO3F](infinity) Layer on the Band Gap: Synthesis, Characterization, and Theoretical Studies of BaZn(2)B(2)O(6 center dot)nBa(2)BO(3)F (n=0, 1, 2)
文献类型：期刊论文
| 作者 | Wu, HP (Wu, Hongping); Su, X (Su, Xin); Han, SJ (Han, Shujuan) ; Yang, ZH (Yang, Zhihua); Pan, SL (Pan, Shilie)
|
| 刊名 | INORGANIC CHEMISTRY
 |
| 出版日期 | 2016 |
| 卷号 | 55期号:10页码:4806-4812 |
| ISSN号 | 0020-1669 |
| DOI | 10.1021/acs.inorgchem.6b00300 |
| 英文摘要 | Two new zincoborate fluorides with the common formula BaZn2B2O6 center dot nBa(2)BO(3)F (n = 1, 2) have been successfully synthesized for the relationship study between the band gaps and crystal structures in zinc-containing borate fluorides. Ba3Zn2B3O9F with n = 1 in the common formula belongs to the orthorhombic space group Pnrrza (No. 20), and Ba5Zn2B4O12F2 with n = 2 in the common formula crystallizes in the monoclinic space group C2/c (No. 62). They can'both be seen as compounds with the n[Ba2BO3F](infinity) (n = 1 or 2) layer inserted in the structure of BaZn2B2O6. UV-vis-near-IR diffuse-reflectance spectra show that the band gaps of BaZn(2)B(2)O(6 center dot)nBa(2)BO(3)F (n = 0, 1, 2) gradually increase with more [Ba2BO3F], layers inserted. The first-principles calculation indicates that the inserted n[Ba2BO3](infinity) layers spectra, thermal behaviors, and refractive indices of these compounds are also studied. |
| WOS记录号 | WOS:000376144000015 |
| 源URL | [http://ir.xjipc.cas.cn/handle/365002/4662]  |
| 专题 | 新疆理化技术研究所_中国科学院特殊环境功能材料与器件重点试验室 新疆理化技术研究所_材料物理与化学研究室 |
| 通讯作者 | Pan, SL (Pan, Shilie) |
| 作者单位 | 1.Univ Chinese Acad Sci, Beijing 100049, Peoples R China 2.Chinese Acad Sci, Xinjiang Tech Inst Phys & Chem, Xinjiang Key Lab Elect Informat Mat & Devices, Key Lab Funct Mat & Devices Special Environm, 40-1 South Beijing Rd, Urumqi 830011, Peoples R China |
| 推荐引用方式 GB/T 7714 | Wu, HP ,Su, X ,Han, SJ ,et al. Effect of the [Ba2BO3F](infinity) Layer on the Band Gap: Synthesis, Characterization, and Theoretical Studies of BaZn(2)B(2)O(6 center dot)nBa(2)BO(3)F (n=0, 1, 2)[J]. INORGANIC CHEMISTRY,2016,55(10):4806-4812. |
| APA | Wu, HP ,Su, X ,Han, SJ ,Yang, ZH ,&Pan, SL .(2016).Effect of the [Ba2BO3F](infinity) Layer on the Band Gap: Synthesis, Characterization, and Theoretical Studies of BaZn(2)B(2)O(6 center dot)nBa(2)BO(3)F (n=0, 1, 2).INORGANIC CHEMISTRY,55(10),4806-4812. |
| MLA | Wu, HP ,et al."Effect of the [Ba2BO3F](infinity) Layer on the Band Gap: Synthesis, Characterization, and Theoretical Studies of BaZn(2)B(2)O(6 center dot)nBa(2)BO(3)F (n=0, 1, 2)".INORGANIC CHEMISTRY 55.10(2016):4806-4812. |
入库方式： OAI收割
来源：新疆理化技术研究所
其他版本
除非特别说明，本系统中所有内容都受版权保护，并保留所有权利。