Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1008649
Preview
Coordinates | 1008649.cif |
---|---|
Original paper (by DOI) | HTML |
External links | AMCSD |
Chemical name | Yttrium barium copper oxide (1/2/3/6.9) |
---|---|
Formula | Ba2 Cu3 O6.877 Y |
Calculated formula | Ba2 Cu3 O6.877 Y |
Title of publication | Electron-density Fourier maps of an untwinned YBa~2~Cu~3~O~6.877~ single crystal by x-ray-diffraction data |
Authors of publication | Sullivan, J D; Bordet, P; Marezio, M; Takenaka, K; Uchida, S |
Journal of publication | Physical Review, Serie 3. B - Condensed Matter (18,1978-) |
Year of publication | 1993 |
Journal volume | 48 |
Journal issue | 14 |
Pages of publication | 10638 - 10641 |
a | 3.8184 ± 0.0003 Å |
b | 3.8857 ± 0.0002 Å |
c | 11.701 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 173.6 Å3 |
Number of distinct elements | 4 |
Space group number | 47 |
Hermann-Mauguin space group symbol | P m m m |
Hall space group symbol | -P 2 2 |
Residual factor for all reflections | 0.035 |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
130149 (current) | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
1008649.cif |
120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1008649.cif |
35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1008649.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. |
1008649.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/' |
1008649.cif |
14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
1008649.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. |
1008649.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) |
1008649.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.