Crystallography Open Database
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Displaying all data in COD
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1000046 | CIF | Ca5 H10 O22 Si6 | I 1 2/m 1 | 5.593; 3.645; 22.45599 90; 96.97; 90 | 454.4 | Hoffmann, C; Armbruster, T Clinotobermorite, Ca5 (Si3 O8 (O H))2 . 4(H2 O) Ca5 (Si6 O17) . 5 (H2 O), a natural C-S-H(I) type cement mineral: determination of the substructure Zeitschrift fuer Kristallographie (149,1979-), 1997, 212, 863-873 |
| 1000047 | CIF | Mg2 O6 Si2 | P b c a | 18.25099; 8.814; 5.181 90; 90; 90 | 833.4 | Yang, H X; Ghose, S High temperature single crystal X-ray diffraction studies of the ortho- proto phase transition in enstatite, Mg2 Si2 O6 at 1360 K Physics and Chemistry of Minerals (Germany), 1995, 22, 300-310 |
| 1000048 | CIF | Al2 Ca2 O7 Si | P -4 21 m | 7.685; 7.685; 5.0636 90; 90; 90 | 299.1 | Swainson, I P; Dove, M T; Schmahl, W W; Putnis, A Neutron Diffraction Study of the Akermanite-Gehlenite Solid Solution Series Physics and Chemistry of Minerals (Germany), 1992, 19, 185-195 |
| 1000049 | CIF | K2 O4 S | P 63/m m c | 5.947; 5.947; 8.375 90; 90; 120 | 256.5 | Miyake, M; Morikawa, H; Iwai, S I Structure Reinvestigation of the High-Temperature Form of K~2~ S O~4~ Acta Crystallographica B (24,1968-38,1982), 1980, 36, 532-536 |
| 1000050 | CIF | Cl K | P m -3 m | 3.634; 3.634; 3.634 90; 90; 90 | 48 | Will, G Energiedispersion und Synchrotronstrahlung: Eine neue Methode und eine neue Strahlenquelle fuer die Roentgenbeugung Fortschritte der Mineralogie, 1981, 59, 31-94 |
| 1000051 | CIF | K N O3 | R 3 m :H | 5.487; 5.487; 9.156 90; 90; 120 | 238.7 | Nimmo, J. K.; Lucas, B. W. The crystal structures of γ- and β-KNO~3~ and the α ←γ ←β phase transformations Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1968-1971 |
| 1000052 | CIF | C4 Ca Mg3 O12 | R 3 2 :H | 9.5027; 9.5027; 7.8212 90; 90; 120 | 611.6 | Dollase, W A; Reeder, R J Crystal structure refinement of Huntite Ca Mg~3~ (C O~3~)~4~ with X-ray powder data American Mineralogist, 1986, 71, 163-166 |
| 1000053 | CIF | Mg O | F m -3 m | 4.217; 4.217; 4.217 90; 90; 90 | 75 | Sasaki, Satoshi; Fujino, Kiyoshi; Takéuchi, Yoshio X-Ray Determination of Electron-Density Distributions in Oxides, MgO, MnO, CoO, and NiO, and Atomic Scattering Factors of their Constituent Atoms Proceedings of the Japan Academy, Series B: Physical and Biological Sciences, 1979, 55, 43-48 |
| 1000054 | CIF | H2 Mg O2 | P -3 m 1 | 3.142; 3.142; 4.766 90; 90; 120 | 40.7 | Zigan, F; Rothbauer, R Neutronenbeugungsmessungen am Brucit Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-), 1967, 1967, 137-143 |
| 1000055 | CIF | B6 La | P m -3 m | 4.157597; 4.157597; 4.157597 90; 90; 90 | 71.87 | Zavalij, P |
| 1000056 | CIF | B14 Mg1.93 | I m a m | 5.97; 8.125; 10.48 90; 90; 90 | 508.35 | Guette, A.; Barret, M.; Naslain, R.; Hagenmuller, P.; Tergenius, L.-E.; Lundström, T. Crystal structure of magnesium heptaboride Mg2B14 Journal of the Less Common Metals, 1981, 82, 325-334 |
| 1000057 | CIF | B6 La | P m -3 m | 4.157; 4.157; 4.157 90; 90; 90 | 71.8 | Eliseev, A A; Efremmov, V A; Kuz'micheva, G M; Konovalova, E S; Lazorenko, V I; Paderno, Y B; Khlyustova, S Y X-ray structural investigation of single crystals of lanthanum, cerium, and samarium hexaborides Kristallografiya, 1986, 31, 803-805 |
| 1000058 | CIF | O2 Ru | P 42/m n m | 4.4968; 4.4968; 3.1049 90; 90; 90 | 62.8 | Bolzan A A; Fong C; Kennedy B J; Howard C J Structural studies of rutile-type metal dioxides Acta Crystallographica, Section B, 1997, 53, 373-380 |
| 1000059 | CIF | Al2 O3 | R -3 c :H | 4.7554; 4.7554; 12.991 90; 90; 120 | 254.4 | Wang, X - L; Hubbard, C R; Alexander, K B; Becher, P F Neutron diffraction measurements of the residual stresses in Al2 O3 - Zr O2 (Ce O2) ceramic composites Journal of the American Ceramic Society, 1994, 77, 1569-1575 |
| 1000060 | CIF | Al2 O5 Ti | B b m m | 9.429; 9.636; 3.591 90; 90; 90 | 326.3 | Morosin, B; Lynch, R W Structure studies on Al~2~ Ti O~5~ at room temperature and at 600C Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1040-1046 |
| 1000061 | CIF | Al H3 O3 | P 1 21/a 1 | 5.062; 8.671; 4.713 90; 90.27; 90 | 206.9 | Rothbauer, R; Zigan, F; O'Daniel, H Verfeinerung der Struktur des Bayerits, Al (O H)3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1967, 125, 317-331 |
| 1000062 | CIF | O2 Sn | P 42/m n m | 4.738; 4.738; 3.1865 90; 90; 90 | 71.5 | Baur, W H; Khan, A A Rutile-Type Compounds. VI. Si O2, Ge O2 and a Comparison with other Rutile-Type Structures Acta Crystallographica B (24,1968-38,1982), 1971, 27, 2133-2139 |
| 1000063 | CIF | Cu2 O | P n -3 m :1 | 4.252; 4.252; 4.252 90; 90; 90 | 76.9 | Neuburger, M C Praezisionsmessung der Gitterkonstante von Cuprooxyd Cu2 O Zeitschrift fuer Physik, 1930, 67, 845-850 |
| 1000064 | CIF | Fe2 O4 Si | P b n m | 4.8195; 10.4788; 6.0873 90; 90; 90 | 307.4 | Fujino, K.; Sasaki, S.; Takeuchi, Y.; Sadanaga, R. X-ray Determination of Electron Distributions in Forsterite, Fayalite and Tephroite Acta Crystallographica B (24,1968-38,1982), 1981, 37, 513-518 |
| 1000065 | CIF | C | R -3 m :H | 2.46; 2.46; 33.45 90; 90; 120 | 175.3 | Nixon, D E; Parry, G S; Ubbelohde, A R Order-disorder transformations in graphite nitrates Proceedings of the Royal Society of London, Series A: Mathematical and Physical Sciences (76,1906-), 1966, 291, 324-339 |
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