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Information card for entry 4317500
Preview
| Coordinates | 4317500.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Sb18 V0.63 Zr10.37 |
|---|---|
| Calculated formula | Sb18 V0.62 Zr10.374 |
| Title of publication | Zr11Sb18: A New Binary Antimonide Exhibiting an Unusual Sb Atom Network with Nonclassical Sb-Sb Bonding |
| Authors of publication | Ingrid Elder; Chi-Shen Lee; Holger Kleinke |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2002 |
| Journal volume | 41 |
| Pages of publication | 538 - 545 |
| a | 6.7648 ± 0.0008 Å |
| b | 6.7648 ± 0.0008 Å |
| c | 60.056 ± 0.009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2748.3 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 122 |
| Hermann-Mauguin space group symbol | I -4 2 d |
| Hall space group symbol | I -4 2bw |
| Residual factor for all reflections | 0.0617 |
| Residual factor for significantly intense reflections | 0.0479 |
| Weighted residual factors for significantly intense reflections | 0.0662 |
| Weighted residual factors for all reflections included in the refinement | 0.0701 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.306 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179255 (current) | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/75. |
4317500.cif |
| 134573 | 2015-04-01 | cod/ (robertas@burundukas) The 'cif_fix_values' script was applied on the CIF files, which had notes in the COD database's table 'validations' generated by the 'cif_validate' validator about misspelling of the enumerable values of the data item '_symmetry_cell_setting'. There was used the option '--fix-only-misspelled'. And there were used 'cif_filter' later in the pipe. Read the log for more details. There were 595 distinct CIF files which had messages from validator. The 'cif_fix_values' script generated 417 messages about corrected misspelled values of enumerators to the log file. Some messages were generated by 'cif_filter' and some changes by the 'cif_filter' were done without messaging to the log file. The 'cif_fix_value' script corrected the enumerators of all data items presented in the file for the replacement of the misspelled values. |
4317500.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4317500.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4317500.cif |
| 12232 | 2011-03-05 | ../uploads/cif-deposit/cod/cif Adding structures of 4317500 via cif-deposit CGI script. |
4317500.cif |
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Users of the data should acknowledge the original authors of the
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