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Information card for entry 4113868
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Coordinates | 4113868.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | Ba O9 Te W2 |
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Calculated formula | Ba O9 Te W2 |
Title of publication | Combining Second-Order Jahn-Teller Distorted Cations to Create Highly Efficient SHG Materials: Synthesis, Characterization, and NLO Properties of BaTeM2O9 (M = Mo6+ or W6+) |
Authors of publication | Hyun-Seup Ra; Kang Min Ok; P. Shiv Halasyamani |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2003 |
Journal volume | 125 |
Pages of publication | 7764 - 7765 |
a | 5.49 ± 0.002 Å |
b | 7.446 ± 0.003 Å |
c | 8.887 ± 0.003 Å |
α | 90° |
β | 90.37 ± 0.006° |
γ | 90° |
Cell volume | 363.3 ± 0.2 Å3 |
Cell temperature | 293 ± 0.2 K |
Ambient diffraction temperature | 293 ± 0.2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0601 |
Residual factor for significantly intense reflections | 0.06 |
Weighted residual factors for significantly intense reflections | 0.1589 |
Weighted residual factors for all reflections included in the refinement | 0.1591 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4113868.html
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