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Information card for entry 1531461
Preview
| Coordinates | 1531461.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Nd2 O3 |
|---|---|
| Calculated formula | Nd2 O3 |
| Title of publication | Ab initio calculation of the crystal structure of the lanthanide Ln2 O3 sesquioxides |
| Authors of publication | Hirosaki, N.; Ogata, S.; Kocer, C. |
| Journal of publication | Journal of Alloys Compd. |
| Year of publication | 2003 |
| Journal volume | 351 |
| Pages of publication | 31 - 34 |
| a | 3.859 Å |
| b | 3.859 Å |
| c | 6.072 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 78.309 Å3 |
| Number of distinct elements | 2 |
| Space group number | 164 |
| Hermann-Mauguin space group symbol | P -3 m 1 |
| Hall space group symbol | -P 3 2" |
| Method of determination | theoretical |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 211196 (current) | 2018-09-27 | cod/ Removing the _chemical_name_common and _chemical_name_systematic data items that contained the summary chemical formula instead of the chemical name from 6249 entries. |
1531461.cif |
| 160574 | 2015-10-06 | cif/1/53/14/ Marking structures from Hirosaki, Ogata and Kocer (2003) as theoretical according to the original publication. |
1531461.cif |
| 156938 | 2015-09-17 | cif/ Adding structures of 1531461 via cif-deposit CGI script. |
1531461.cif |
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Users of the data should acknowledge the original authors of the
structural data.