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Information card for entry 4004014
Preview
Coordinates | 4004014.cif |
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Original paper (by DOI) | HTML |
Formula | Ge3 O14 Pb3 Te Zn2 |
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Calculated formula | Ge2.9999 O14 Pb3 Te Zn2.0001 |
Title of publication | A3Te(Zn2Ge)Ge2O14 (A = Sr, Ba, and Pb): New Langasite Mid-infrared Nonlinear Optical Materials by Rational Chemical Substitution |
Authors of publication | Chen, Kaichuang; Lin, Chensheng; Zhang, Shengzi; Peng, Guang; Chen, Yu; Zhao, Dan; Fan, Huixin; Yang, Shunda; Wen, Xin; Luo, Min; Lin, Zheshuai; Ye, Ning |
Journal of publication | Chemistry of Materials |
Year of publication | 2021 |
a | 8.5194 ± 0.0006 Å |
b | 8.5194 ± 0.0006 Å |
c | 5.1235 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 322.04 ± 0.05 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 150 |
Hermann-Mauguin space group symbol | P 3 2 1 |
Hall space group symbol | P 3 2" |
Residual factor for all reflections | 0.0337 |
Residual factor for significantly intense reflections | 0.0327 |
Weighted residual factors for significantly intense reflections | 0.0647 |
Weighted residual factors for all reflections included in the refinement | 0.0652 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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267745 (current) | 2021-07-26 | cif/ Adding structures of 4004014 via cif-deposit CGI script. |
4004014.cif |
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