Information card for entry 7227021
Formula |
B6 Br0.67 Cl0.33 K3 O10 |
Calculated formula |
B6 Br0.651 Cl0.349 K3 O10 |
Title of publication |
Chemical engineering of mixed halide hexaborates as nonlinear optical materials |
Authors of publication |
Xia, Mingjun; Hou, Zhanyu; Yang, Yi; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Lin, Zheshuai; Li, R.K.; Chen, Chuangtian |
Journal of publication |
RSC Adv. |
Year of publication |
2016 |
a |
10.099 ± 0.0004 Å |
b |
10.099 ± 0.0004 Å |
c |
8.858 ± 0.0005 Å |
α |
90° |
β |
90° |
γ |
120° |
Cell volume |
782.39 ± 0.06 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296 ± 2 K |
Number of distinct elements |
5 |
Space group number |
160 |
Hermann-Mauguin space group symbol |
R 3 m :H |
Hall space group symbol |
R 3 -2" |
Residual factor for all reflections |
0.0202 |
Residual factor for significantly intense reflections |
0.02 |
Weighted residual factors for significantly intense reflections |
0.0483 |
Weighted residual factors for all reflections included in the refinement |
0.0484 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.126 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/7227021.html