Crystallography Open Database
Search results
Result: there are 195 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Acta Crystallographica Section A'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9007495 | CIF | Mn Nb O6 Ta | P b c n | 14.418; 5.76; 5.099 90; 90; 90 | 423.46 | Klein, S.; Weitzel, H. Magnetische struktur von Mn(Nb0.5Ta0.5)2O6, manganotantalit Note: columbite structure Acta Crystallographica, Section A, 1976, 32, 587-591 |
| 9007496 | CIF | Al2 O3 | R -3 c :H | 4.7602; 4.7602; 12.9933 90; 90; 120 | 254.977 | Lewis, J.; Schwarzenbach, D.; Flack, H. D. Electric field gradients and charge density in corundum alpha-Al2O3 Acta Crystallographica, Section A, 1982, 38, 733-739 |
| 9007497 | CIF | Cu2 O | P n -3 m :1 | 4.2685; 4.2685; 4.2685 90; 90; 90 | 77.772 | Kirfel, A.; Eichhorn, K. Accurate structure analysis with synchrotron radiation. The electron density in Al2O3 and Cu2O Note: Atomic parameters were mislabeled in the publication. They have been fixed in this dataset. Acta Crystallographica, Section A, 1990, 46, 271-284 |
| 9007498 | CIF | Al2 O3 | R -3 c :H | 4.757; 4.757; 12.9877 90; 90; 120 | 254.524 | Kirfel, A.; Eichhorn, K. Accurate structure analysis with synchrotron radiation. The electron density in Al2O3 and Cu2O Acta Crystallographica, Section A, 1990, 46, 271-284 |
| 9007499 | CIF | Ba0.4 O8 Ti4 | I 4/m | 10.12; 10.12; 2.96 90; 90; 90 | 303.147 | Xiang, Shi-Bin; Fan, Hai-Fu; Wu, Xiao-Jing; Li, Fang-Hua; Pan, Q. Direct methods in superspace. II The first application to an unknown incommensurate modulated structure Note: this is the average structure, isomorphous with hollandite Note: y-coordinate of O2 altered from .248 to make regular TiO6 polyhedra Acta Crystallographica, Section A, 1990, 46, 929-934 |
| 9011072 | CIF | C6 D6 Fe K4 N6 O3 | A 1 2/a 1 | 9.415; 17.006; 9.382 90; 90.03; 90 | 1502.17 | Taylor, J. C.; Mueller, M. H.; Hitterman, R. L. A neutron diffraction study of ferroelectric KFCT, K4Fe(CN)6*3D2O, above the Curie temperature Locality: synthetic Acta Crystallographica, Section A, 1970, 26, 559-567 |
| 9011073 | CIF | C60 | F m -3 | 14.26; 14.26; 14.26 90; 90; 90 | 2899.74 | Dorset, D. L.; McCourt, M. P. Disorder and the molecular packing of C60 buckminsterfullerene: a direct electron-crystallographic analysis Sample: room T Acta Crystallographica, Section A, 1994, 50, 344-351 |
| 9011074 | CIF | Fe0.24 Ni7.76 P0.63 Si2.37 | R -3 c :H | 6.64; 6.64; 37.9819 90; 90; 120 | 1450.25 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011075 | CIF | Pd8 Sb3 | R -3 c :H | 7.6152; 7.6152; 43.032 90; 90; 120 | 2161.15 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011076 | CIF | C14 N4 O2 Pt | C m c m | 18.722; 11.889; 6.688 90; 90; 90 | 1488.65 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011077 | CIF | C9 H17 O4 P | P 1 21/n 1 | 12.385; 6.59; 13.394 90; 98; 90 | 1082.54 | Marsh, R. E. The centrosymmetric - noncentrosymmetric ambiguity: some more examples Acta Crystallographica, Section A, 1994, 50, 450-455 |
| 9011078 | CIF | H12 Ni O10 S | P 41 21 2 | 6.782; 6.782; 18.274 90; 90; 90 | 840.522 | Rousseau, B.; Maes, S. T.; Lenstra, A. T. H. Systematic intensity errors and model imperfection as the consequence of spectral truncation Acta Crystallographica, Section A, 2000, 56, 300-307 |
| 9011079 | CIF | Cl K O4 | P n m a | 8.7684; 5.6237; 7.2039 90; 90; 90 | 355.23 | Marabello, D.; Bianchi, R.; Gervasio, G.; Cargnoni, F. An experimental (120K) and theoretical electron-density study of KMnO4 and KClO4 Locality: synthetic Note: potassium perchlorate T = 120 K Acta Crystallographica, Section A, 2004, 60, 494-501 |
| 9012032 | CIF | Be | P 63/m m c | 2.2858; 2.2858; 3.5843 90; 90; 120 | 16.219 | Yang, Y. W.; Coppens, P. The electron density and bonding in beryllium metal as studied by Fourier methods Acta Crystallographica Section A, 1978, 34, 61-65 |
| 9016056 | CIF | Cd Se | P 63 m c | 4.299; 4.299; 7.01 90; 90; 120 | 112.198 | Freeman, D. K.; Mair, S. L.; Barnea, Z. The structure and Bijvoet ratios of cadmium selenide Acta Crystallographica, Section A, 1977, 33, 355-359 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!