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Information card for entry 4105648
Preview
| Coordinates | 4105648.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Calcium Technitium Oxide |
|---|---|
| Formula | Ca O3 Tc |
| Calculated formula | Ca O3 Tc |
| Title of publication | Antiferromagnetism in a Technetium Oxide. Structure of CaTcO3 |
| Authors of publication | Maxim Avdeev; Gordon J. Thorogood; Melody L. Carter; Brendan J. Kennedy; Jimmy Ting; David J. Singh; Kia S. Wallwork |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2011 |
| Journal volume | 133 |
| Pages of publication | 1654 - 1657 |
| a | 5.5373 ± 0.0001 Å |
| b | 7.7118 ± 0.0002 Å |
| c | 5.4004 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 230.611 ± 0.008 Å3 |
| Cell temperature | 4 K |
| Ambient diffraction temperature | 4 K |
| Number of distinct elements | 3 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor R(I) for significantly intense reflections | 12.48 |
| Goodness-of-fit parameter for all reflections | 4.8 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | neutron |
| Diffraction radiation wavelength | 1.885 Å |
| Diffraction radiation type | neutron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178802 (current) | 2016-03-21 | cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/56. |
4105648.cif |
| 106285 | 2014-03-15 | cod/ (saulius@kolibris) Adding the '_diffrn_radiation_probe neutron' data item to those COD CIFs that declared neuron radiation in their _diffrn_radiation_type data field, and did not have a _diffrn_radiation_probe item yet: codsql 'select file from data where radiation is null and radType like "%neutron%"' -NB \ | codid2file \ | xargs -i sh -c 'test -f {} && ( set -x; echo _diffrn_radiation_probe neutron >> {} )' Two files that had no newlines at the end were fixed manually. |
4105648.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4105648.cif |
| 52408 | 2012-04-11 | ../uploads/cif-deposit/cod/cif Adding structures of 4105648 via cif-deposit CGI script. |
4105648.cif |
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Users of the data should acknowledge the original authors of the
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