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Information card for entry 4000502
Preview
Coordinates | 4000502.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | B4 La0.72 O12 Sc2.71 Y0.57 |
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Calculated formula | B4 La0.72 O12 Sc2.7099 Y0.5701 |
Title of publication | Nonlinear Optical Crystal Y~x~La~y~Sc~z~(BO~3~)~4~ (x + y + z = 4) |
Authors of publication | Ye, Ning; Stone-Sundberg, Jennifer L.; Hruschka, Michael A.; Aka, Gerard; Kong, Wei; Keszler, Douglas A. |
Journal of publication | Chemistry of Materials |
Year of publication | 2005 |
Journal volume | 17 |
Journal issue | 10 |
Pages of publication | 2687 - 2692 |
a | 9.7739 ± 0.001 Å |
b | 9.7739 ± 0.001 Å |
c | 7.9456 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 657.34 ± 0.15 Å3 |
Cell temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 155 |
Hermann-Mauguin space group symbol | R 3 2 :H |
Hall space group symbol | R 3 2" |
Residual factor for significantly intense reflections | 0.0296 |
Weighted residual factors for all reflections included in the refinement | 0.0815 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178239 (current) | 2016-03-17 | cif/ (antanas@echidna.ibt.lt) Adding full bibliography and additional information from the original publication for entry 4000502. Marking entry 1100933 as a duplicate of entry 4000502. |
4000502.cif |
120677 | 2014-07-23 | cod/ (saulius@koala.ibt.lt) Adding 4906 DOIs identified by CodBot. |
4000502.cif |
34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4000502.cif |
966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
4000502.cif |
853 | 2009-11-16 | cif/ Reconstructing spacegroup designators from the symmetry operators were possible. The comands used can be found in the log file reformat-spacegroups-2009.11.14.log committed with the current revision. Only lines that contained spacegroup designators were changed, and all files pass vcif test after the conversion. |
4000502.cif |
19 | 2008-01-26 | Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif | xargs perl -i -pe 's/\r\n/\n/' |
4000502.cif |
14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
4000502.cif |
13 | 2008-01-13 | Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory. |
4000502.cif |
1 | 2007-11-30 | Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29) |
4000502.cif |
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Users of the data should acknowledge the original authors of the
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