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Information card for entry 1513252
Preview
| Coordinates | 1513252.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Ba O3 Ti |
|---|---|
| Calculated formula | Ba O3 Ti |
| Title of publication | X-ray diffractometry for the structure determination of a submicrometre single powder grain |
| Authors of publication | Yasuda, Nobuhiro; Murayama, Haruno; Fukuyama, Yoshimitsu; Kim, Jungeun; Kimura, Shigeru; Toriumi, Koshiro; Tanaka, Yoshihito; Moritomo, Yutaka; Kuroiwa, Yoshihiro; Kato, Kenichi; Tanaka, Hitoshi; Takata, Masaki |
| Journal of publication | Journal of Synchrotron Radiation |
| Year of publication | 2009 |
| Journal volume | 16 |
| Journal issue | 3 |
| Pages of publication | 352 - 357 |
| a | 3.9905 ± 0.0013 Å |
| b | 3.9905 ± 0.0013 Å |
| c | 4.0412 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 64.35 ± 0.04 Å3 |
| Cell temperature | 300 ± 2 K |
| Ambient diffraction temperature | 300 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 99 |
| Hermann-Mauguin space group symbol | P 4 m m |
| Hall space group symbol | P 4 -2 |
| Residual factor for all reflections | 0.0575 |
| Residual factor for significantly intense reflections | 0.0524 |
| Weighted residual factors for significantly intense reflections | 0.0994 |
| Weighted residual factors for all reflections included in the refinement | 0.1024 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.168 |
| Diffraction radiation wavelength | 0.83351 Å |
| Diffraction radiation type | Synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1513252.cif |
| 130086 | 2015-01-23 | cod/ (robertas@burundukas) The 'cif_fix_values' program was applied to CIFs that have generated the validation messages containing tag '_exptl_crystal_density_meas'. 16946 CIFs had a values that were perceived as 'not measured' and they were changed to '?'. The total of 17089 CIFs was changed. Those that were not corrected by 'cif_fix_values' were reformatted by the parser (e.g. a doi tag was moved to another place). The processing command was: mysql -u cod_reader -h www.crystallography.net cod -e \ 'select distinct codid from validation \ where message like \ "%tag%_exptl_crystal_density_meas'\''%"' -NB \ | xargs -i sh -c 'cif_fix_values {} \ | cif_filter --add-cif-header {} \ | sponge {}' |
1513252.cif |
| 97630 | 2014-01-29 | cif/ Adding structures of 1513252 via cif-deposit CGI script. |
1513252.cif |
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Users of the data should acknowledge the original authors of the
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