Crystallography Open Database
Search results
Result: there are 3714 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 space group like 'R -3 :H'
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 9010201 | CIF | C Cd0.5 Mg0.5 O3 | R -3 :H | 4.7822; 4.7822; 15.691 90; 90; 120 | 310.768 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 500 C, 1 GPa, 96 h Sample: disordered at T = 600 C, t = 20 min American Mineralogist, 2007, 92, 829-836 |
| 9010202 | CIF | C Cd0.5 Mg0.5 O3 | R -3 :H | 4.7819; 4.7819; 15.698 90; 90; 120 | 310.868 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 500 C, 1 GPa, 96 h Sample: disordered at T = 600 C, t = 48 h American Mineralogist, 2007, 92, 829-836 |
| 9010207 | CIF | C Cd0.6 Mg0.4 O3 | R -3 :H | 4.8113; 4.8113; 15.8356 90; 90; 120 | 317.461 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .4, synthesized at 600 C, 1 GPa, 3 h American Mineralogist, 2007, 92, 829-836 |
| 9010208 | CIF | C Cd0.5 Mg0.5 O3 | R -3 :H | 4.7792; 4.7792; 15.6884 90; 90; 120 | 310.327 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 600 C, 1 GPa, 3 h American Mineralogist, 2007, 92, 829-836 |
| 9010209 | CIF | C Cd0.4 Mg0.6 O3 | R -3 :H | 4.759; 4.759; 15.5956 90; 90; 120 | 305.889 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .6, synthesized at 600 C, 1 GPa, 3 h American Mineralogist, 2007, 92, 829-836 |
| 9010211 | CIF | C Cd0.6 Mg0.4 O3 | R -3 :H | 4.8116; 4.8116; 15.8303 90; 90; 120 | 317.394 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .4, synthesized at 600 C, 1 GPa, 19 h American Mineralogist, 2007, 92, 829-836 |
| 9010212 | CIF | C Cd0.55 Mg0.45 O3 | R -3 :H | 4.7963; 4.7963; 15.7663 90; 90; 120 | 314.104 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .45, synthesized at 600 C, 1 GPa, 19 h American Mineralogist, 2007, 92, 829-836 |
| 9010213 | CIF | C Cd0.5 Mg0.5 O3 | R -3 :H | 4.7813; 4.7813; 15.7023 90; 90; 120 | 310.875 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 600 C, 1 GPa, 19 h American Mineralogist, 2007, 92, 829-836 |
| 9010214 | CIF | C Cd0.45 Mg0.55 O3 | R -3 :H | 4.7752; 4.7752; 15.673 90; 90; 120 | 309.504 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .55, synthesized at 600 C, 1 GPa, 19 h American Mineralogist, 2007, 92, 829-836 |
| 9010215 | CIF | C Cd0.5 Mg0.5 O3 | R -3 :H | 4.7818; 4.7818; 15.7028 90; 90; 120 | 310.95 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 600 C, 1 GPa, 96 h American Mineralogist, 2007, 92, 829-836 |
| 9010216 | CIF | C Cd0.5 Mg0.5 O3 | R -3 :H | 4.7824; 4.7824; 15.7082 90; 90; 120 | 311.135 | Bromiley, F. A.; Boffa Ballaran, T.; Langenhorst, F.; Seifert, F. Order and miscibility in the otavite - magnesite solid solution Sample: X_Mg = .5, synthesized at 650 C, 1 GPa, 120 h American Mineralogist, 2007, 92, 829-836 |
| 9010581 | CIF | Mg0.1 Mn0.9 O3 Ti | R -3 :H | 5.1303; 5.1303; 14.2428 90; 90; 120 | 324.647 | Liferovich, R. P.; Mitchell, R. H. The pyrophanite-geikielite solid-solution series: crystal structures of the Mn1-xMgxTiO3 series (0 < x < 0.7) Sample: XMg = 0.1 The Canadian Mineralogist, 2006, 44, 1099-1107 |
| 9010582 | CIF | Mg0.2 Mn0.8 O3 Ti | R -3 :H | 5.1234; 5.1234; 14.2054 90; 90; 120 | 322.924 | Liferovich, R. P.; Mitchell, R. H. The pyrophanite-geikielite solid-solution series: crystal structures of the Mn1-xMgxTiO3 series (0 < x < 0.7) Sample: XMg = 0.2 The Canadian Mineralogist, 2006, 44, 1099-1107 |
| 9010583 | CIF | Mg0.3 Mn0.7 O3 Ti | R -3 :H | 5.1149; 5.1149; 14.1614 90; 90; 120 | 320.857 | Liferovich, R. P.; Mitchell, R. H. The pyrophanite-geikielite solid-solution series: crystal structures of the Mn1-xMgxTiO3 series (0 < x < 0.7) Sample: XMg = 0.3 The Canadian Mineralogist, 2006, 44, 1099-1107 |
| 9010584 | CIF | Mg0.4 Mn0.6 O3 Ti | R -3 :H | 5.1084; 5.1084; 14.1286 90; 90; 120 | 319.3 | Liferovich, R. P.; Mitchell, R. H. The pyrophanite-geikielite solid-solution series: crystal structures of the Mn1-xMgxTiO3 series (0 < x < 0.7) Sample: XMg = 0.4 The Canadian Mineralogist, 2006, 44, 1099-1107 |
| 9010585 | CIF | Mg0.5 Mn0.5 O3 Ti | R -3 :H | 5.1007; 5.1007; 14.091 90; 90; 120 | 317.491 | Liferovich, R. P.; Mitchell, R. H. The pyrophanite-geikielite solid-solution series: crystal structures of the Mn1-xMgxTiO3 series (0 < x < 0.7) Sample: XMg = 0.5 The Canadian Mineralogist, 2006, 44, 1099-1107 |
| 9010586 | CIF | Mg0.6 Mn0.4 O3 Ti | R -3 :H | 5.0921; 5.0921; 14.0532 90; 90; 120 | 315.573 | Liferovich, R. P.; Mitchell, R. H. The pyrophanite-geikielite solid-solution series: crystal structures of the Mn1-xMgxTiO3 series (0 < x < 0.7) Sample: XMg = 0.6 The Canadian Mineralogist, 2006, 44, 1099-1107 |
| 9010587 | CIF | Mg O3 Ti | R -3 :H | 5.0567; 5.0567; 13.9034 90; 90; 120 | 307.883 | Liferovich, R. P.; Mitchell, R. H. The pyrophanite-geikielite solid-solution series: crystal structures of the Mn1-xMgxTiO3 series (0 < x < 0.7) Sample: XMg = 1.0 Note: No bond lengths could be reproduced with the reported dataset The Canadian Mineralogist, 2006, 44, 1099-1107 |
| 9010768 | CIF | H6 Mn23.52 Na5.81 O72.48 P18 | R -3 :H | 15.2741; 15.2741; 43.334 90; 90; 120 | 8755.29 | Keller, P.; Hatert, F.; Lissner, F.; Schleid, T.; Fransolet, A. M. Hydrothermal synthesis and crystal structure of Na(NaMn)7Mn22(PO4)18*0.5H2O, a new compund of fillowite structure type European Journal of Mineralogy, 2006, 18, 765-774 |
| 9010912 | CIF | Fe O3 Ti | R -3 :H | 5.0881; 5.0881; 14.091 90; 90; 120 | 315.925 | Yamanaka, T.; Komatsu, Y.; Nomori, H. Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 1 atm Physics and Chemistry of Minerals, 2007, 34, 307-318 |
| 9010913 | CIF | Fe O3 Ti | R -3 :H | 5.0678; 5.0678; 13.9956 90; 90; 120 | 311.287 | Yamanaka, T.; Komatsu, Y.; Nomori, H. Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 3.6 Gpa Physics and Chemistry of Minerals, 2007, 34, 307-318 |
| 9010914 | CIF | Fe O3 Ti | R -3 :H | 5.0567; 5.0567; 13.8892 90; 90; 120 | 307.569 | Yamanaka, T.; Komatsu, Y.; Nomori, H. Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 5.3 GPa Physics and Chemistry of Minerals, 2007, 34, 307-318 |
| 9010915 | CIF | Fe O3 Ti | R -3 :H | 5.0398; 5.0398; 13.7968 90; 90; 120 | 303.484 | Yamanaka, T.; Komatsu, Y.; Nomori, H. Electron density distribution of FeTiO3 ilmenite under high pressure analyzed by MEM using single crystal diffraction intensities Locality: synthetic Sample: P = 8.2 GPa Physics and Chemistry of Minerals, 2007, 34, 307-318 |
| 9011261 | CIF | Mg O3 Ti | R -3 :H | 5.05478; 5.05478; 13.8992 90; 90; 120 | 307.557 | Wechsler, B. A.; Von Dreele, R. B. Structure refinements of Mg2TiO4, MgTiO3 and MgTi2O5 by time-of-flight neutron powder diffraction Locality: synthetic Acta Crystallographica, Section B, 1989, 45, 542-549 |
| 9011469 | CIF | Al Li O4 Si | R -3 :H | 13.473; 13.473; 9.001 90; 90; 120 | 1414.98 | Hesse, K. F. Crystal structures of natural and synthetic alpha-eucryptite, LiAlSiO4 Zeitschrift fur Kristallographie, 1985, 172, 147-151 |
| 9011470 | CIF | Al Li O4 Si | R -3 :H | 13.471; 13.471; 8.998 90; 90; 120 | 1414.09 | Hesse, K. F. Crystal structures of natural and synthetic alpha-eucryptite, LiAlSiO4 Zeitschrift fur Kristallographie, 1985, 172, 147-151 |
| 9011499 | CIF | Al2 O12 S3 | R -3 :H | 8.0246; 8.0246; 21.357 90; 90; 120 | 1191.02 | Dahmen, T.; Gruehn, R. Beitrage zum thermischen verhalten von sulfaten. IX. Einkristallstrukturverfeinerung der metall(III)-sulfate Cr2(SO4)3 und Al2(SO4)3 Locality: synthetic Zeitschrift fur Kristallographie, 1993, 204, 57-65 |
| 9011500 | CIF | Cr2 O12 S3 | R -3 :H | 8.1245; 8.1245; 21.944 90; 90; 120 | 1254.41 | Dahmen, T.; Gruehn, R. Beitraege zum thermischen verhalten von sulfaten. IX. Einkristallstrukturverfeinerung der metall(III)-sulfate Cr2(SO4)3 und Al2(SO4)3 Zeitschrift fur Kristallographie, 1993, 204, 57-65 |
| 9011956 | CIF | Fe H11 O10 S | R -3 :H | 24.17699; 24.17699; 7.656 90; 90; 120 | 3875.58 | Scordari, F. Fibroferrite: A mineral with a {Fe(OH)(H2O)2SO4} spiral chain and its relationship to Fe(OH)SO4, butlerite and parabutlerite Locality: Saint Felix de Pailleres, France Tschermaks Mineralogische und Petrographische Mitteilungen, 1981, 28, 17-29 |
| 9012000 | CIF | Cl3 Fe | R -3 :H | 6.065; 6.065; 17.42 90; 90; 120 | 554.933 | Hashimoto, S.; Forster, K.; Moss, S. C. Structure refinement of an FeCl3 crystal using a thin plate sample Journal of Applied Crystallography, 1988, 22, 173-180 |
| 9012070 | CIF | Ba2 O32 Ta15 | R -3 :H | 7.773; 7.773; 35.414 90; 90; 120 | 1853.03 | Siegrist, T.; Cava, R. J.; Krajewski, J. J. Reduced alkaline earth tantalates Materials Research Bulletin, 1997, 32, 881-887 |
| 9012185 | CIF | Ca6.5 F21.5 Y3 | R -3 :H | 16.962; 16.962; 9.6664 90; 90; 120 | 2408.52 | Bevan, D. J. M.; Strahle, J.; Greis, O. The crystal structure of tveitite, an ordered yttrofluorite mineral Note: a and b adjusted to match reported bond lengths Journal of Solid State Chemistry, 1982, 44, 75-81 |
| 9012311 | CIF | S6 | R -3 :H | 10.818; 10.818; 4.28 90; 90; 120 | 433.779 | Donohue, J.; Caron, A.; Goldish, E. The crystal and molecular structure of S6 (sulfur-6) Locality: synthetic Journal of the American Chemical Society, 1961, 83, 3748-3751 |
| 9012361 | CIF | S6 | R -3 :H | 10.766; 10.766; 4.225 90; 90; 120 | 424.098 | Steidel, J.; Pickardt, J.; Steudel, R. Redetermination of the crystal and molecular structure of cyclohexasulfur, S6 Zeitschrift fur Naturforschung B, 1978, 33, 1554-1555 |
| 9012386 | CIF | Pd20 Sb7 | R -3 :H | 11.734; 11.734; 11.021 90; 90; 120 | 1314.15 | Wopersnow, W.; Schubert, K. Kristallstrukturen von Pd20Sb7 und Pd20Te7 Note: isotypic with keithconnite Journal of the Less-Common Metals, 1977, 51, 35-44 |
| 9012398 | CIF | Ca13 F10 H12 O34 Si10 | R -3 :H | 9.377; 9.377; 36.57 90; 90; 120 | 2784.73 | Mikenda, W.; Pertlik, F.; Povondra, P.; Ulrych, J. On zeophyllite from Radejcin, Ceske stredohori Mts.: X-ray and IR-investigations Locality: Alter Berg, Radzein Note: z-coordinate of Si2 was changed from 0.70304 to 0.07304 to match reported bond lengths Mineralogy and Petrology, 1997, 61, 199-209 |
| 9012665 | CIF | Ca9.434 F41.06 Ho0.48 Na1.958 Nd0.954 Y5.298 | R -3 :H | 17.02; 17.02; 9.679 90; 90; 120 | 2428.18 | Yakubovich, O. V.; Massa, W.; Pekov, I. V.; Gavrilenko, P. G. Crystal structure of tveitite-(Y): fractionation of rare-earth elements between positions and the variety of defects Crystallography Reports, 2007, 52, 71-79 |
| 9013138 | CIF | Se6 | R -3 :H | 11.362; 11.362; 4.429 90; 90; 120 | 495.16 | Miyamoto, Y. Structure and phase transformation of rhombohedral selenium composed of Se6 molecules Locality: synthetic Japanese Journal of Applied Physics, 1980, 19, 1813-1819 |
| 9013423 | CIF | Al Ca2 H22 O11 S0.5 | R -3 :H | 5.7586; 5.7586; 26.7946 90; 90; 120 | 769.506 | Allmann, R. Refinement of the hybrid layer structure [Ca2Al(OH)6]+*[1/2SO4*3H2O]- Note: z(Wat1) adjusted to match reported bond lengths Neues Jahrbuch fur Mineralogie, Monatshefte, 1977, 1977, 136-144 |
| 9013701 | CIF | Fe5 H66 Mg2 O67.669 S7 | R -3 :H | 12.1347; 12.1347; 34.706 90; 90; 120 | 4425.81 | Parafiniuk, J.; Dobrzycki, L.; Wozniak, K. Slavikite - revision of chemical composition and crystal structure American Mineralogist, 2010, 95, 11-18 |
| 9013944 | CIF | Cl2 Cu3 H6 O6 Zn | R -3 :H | 6.834; 6.834; 14.075 90; 90; 120 | 569.284 | Braithwaite, R. S. W.; Mereiter, K.; Paar, W. H.; Clark, A. M. Herbertsmithite, Cu3Zn(OH)6Cl2, a new species and the definition of paratacamite Locality: Mina Los Tres Presidentes, Sierra Gorda, Chile Mineralogical Magazine, 2004, 68, 527-539 |
| 9014091 | CIF | Al6 F6 H72 Mg0.5 O64 S7 | R -3 :H | 22.01; 22.01; 9.238 90; 90; 120 | 3875.69 | Demartin, F.; Gramaccioli, C. M.; Campostrini, I.; Castellano, C. Cossaite, (Mg0.5,_)Al6(SO4)6(HSO4)F6*36H2O, a new mineral from La Fossa crater, Vulcano, Aeolian Islands, Italy Note: H atom in HSO4 group was not located Mineralogical Magazine, 2011, 75, 2847-2855 |
| 9014832 | CIF | O4 Si Zn2 | R -3 :H | 13.971; 13.971; 9.334 90; 90; 120 | 1577.81 | Simonov, M. A.; Sandomirskii, P. A.; Egorov-Tismenko Y K; Belov, N. V. The crystal structure of willemite Zn2[SiO4] Doklady Akademii Nauk SSSR, 1977, 237, 581-584 |
| 9014901 | CIF | C2 H30 Mg O18 S2 | R -3 :H | 9.2715; 9.2715; 21.1298 90; 90; 120 | 1572.99 | Genceli Guner, F. E.; Lutz, M.; Sakurai, T.; Spek, A. L.; Hondoh, T. Crystallization and characterization of magnesium methanesulfonate hydrate Mg(CH3SO3)2*12H2O Note: T = 110 K Crystal Growth & Design, 2010, 10, 4327-4333 |
| 9015271 | CIF | Al2.46 Cu2.86 H36 O36 Sb3 Zn3.68 | R -3 :H | 5.34; 5.34; 88.01 90; 90; 120 | 2173.43 | Mills, S. J.; Christy, A. G.; Kampf, A. R.; Housley, R. M.; Favreau, G.; Boulliard, J. C.; Bourgoin, V. Zincalstibite-9R: the first nine-layer polytype with the layered double hydroxide structure-type Mineralogical Magazine, 2012, 76, 1337-1345 |
| 9015979 | CIF | Na Nb O3 | R -3 :H | 5.335; 5.335; 15.611 90; 90; 120 | 384.796 | Kumada, N.; Kinomura, N.; Muto, F. Crystal structures of ilmenite type LiNbO~3~ and NaNbO~3~ Journal of the Ceramic Society of Japan, 1990, 98, 384-388 |
| 9016248 | CIF | Li Nb O3 | R -3 :H | 5.212; 5.212; 14.356 90; 90; 120 | 337.733 | Kumada, N.; Kinomura, N.; Muto, F. Crystal structures of ilmenite type LiNbO~3~ and NaNbO~3~ Journal of the Ceramic Society of Japan, 1990, 98, 384-388 |
| 9016395 | CIF | H24 N6 O19 P6 | R -3 :H | 15.445; 15.445; 7.553 90; 90; 120 | 1560.36 | Averbuch-Pouchot M Structure of ammonium cyclo-hexaphosphate monohydrate _cod_database_code 1008850 Acta Crystallographica, Section C, 1989, 45, 539-540 |
| 9016449 | CIF | Fe1.04 Mg0.02 Mn1.87 Na0.18 O38 Pb0.61 Sr0.39 Ti7.02 U0.02 V7.74 Zn0.25 | R -3 :H | 10.3894; 10.3894; 20.8709 90; 90; 120 | 1950.98 | Mills, S. J.; Bindi, L.; Cadoni, M.; Kampf, A. R.; Ciriotti, M. E.; Ferraris, G. Paseroite, PbMn2+(Mn2+,Fe2+)2(V5+,Ti,Fe3+,_)18O38, a new member of the crichtonite group European Journal of Mineralogy, 2012, 24, 1061-1067 |
| 9016519 | CIF | Cl5 Cu6 H7 O13 Pb3 Te | R -3 :H | 8.4035; 8.4035; 44.681 90; 90; 120 | 2732.59 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Marty, J. Lead-tellurium oxysalts from Otto Mountain near Baker, California: VIII. Fuettererite, Pb3Cu2+6Te6+O6(OH)7Cl5, a new mineral with double spangolite-type sheets American Mineralogist, 2013, 98, 506-511 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

