Crystallography Open Database
Search results
Result: there are 527382 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
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Displaying all data in COD
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9014662 | CIF | Al7.191 B3 Ca0.51 F0.753 Fe0.027 H3.246 Li1.359 Mn0.423 Na0.408 O30.246 Pb0.026 Si6 | R 3 m :H | 15.853; 15.853; 7.12 90; 90; 120 | 1549.65 | Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S. Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L12, disordered model The Canadian Mineralogist, 2011, 49, 63-88 |
| 9014664 | CIF | Al0.162 Fe0.18 H4 Mg2.694 O9 Si1.886 | P 3 1 m | 5.3244; 5.3244; 7.268 90; 90; 120 | 178.438 | Laurora, A.; Brigatti, M. F.; Malferrari, D.; Galli, E.; Rossi, A. The crystal chemistry of lizardite-1T from northern Apennines ophiolites near Modena, Italy Note: Pompeano 4, polytype 1T The Canadian Mineralogist, 2011, 49, 1045-1054 |
| 9014665 | CIF | H7 Mg O7 P | P b c a | 10.215; 10.681; 10.014 90; 90; 90 | 1092.59 | Sutor, D. J. The crystal and molecular structure of newberyite, MgHPO4*3H2O Acta Crystallographica, 1967, 23, 418-422 |
| 9014668 | CIF | Ba O3 Ti | P 4 m m | 3.9988; 3.9988; 4.0222 90; 90; 90 | 64.317 | Xiao, C. J.; Jin, C. Q.; Wang, X. H. Crystal structure of dense nanocrystalline BaTiO3 ceramics Note: phase T (tetragonal) Materials Chemistry and Physics, 2008, 111, 209-212 |
| 9014669 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.4572; 11.4572; 11.4572 90; 90; 90 | 1503.96 | Nakatsuka, A.; Shimokawa, M.; Nakayama, N.; Ohtaka, O.; Arima, H.; Okube, M.; Yoshiasa, A. Static disorders of atoms and experimental determination of Debye temperature in pyrope: Low- and high-temperature single-crystal X-ray diffraction study Note: T = 295 K American Mineralogist, 2011, 96, 1593-1605 |
| 9014670 | CIF | Be6 Ca4 H10 Na2 O32 Si8 | P 1 21 1 | 7.1222; 19.8378; 9.8071 90; 111.287; 90 | 1291.1 | Grice, J. D.; Raade, G.; Cooper, M. A. Alflarsenite: Structure and relationship to other Be-Si and zeolite framework structures Note: x-coordinate for O7 changed by authors The Canadian Mineralogist, 2010, 48, 255-266 |
| 9014672 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.7848; 9.1369; 5.1936 90; 101.764; 90 | 454.569 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 100 K American Mineralogist, 2012, 97, 694-706 |
| 9014675 | CIF | Cu1.55 Fe0.45 Se2 Tl | I 4/m m m | 3.976; 3.976; 13.7 90; 90; 90 | 216.577 | Makovicky, E.; Johan, Z.; Karup-Moller S New data on bukovite, thalcusite, chalcothallite and rohaite Neues Jahrbuch fur Mineralogie, Abhandlungen, 1980, 138, 122-146 |
| 9014678 | CIF | As S | P 1 21/n 1 | 9.065; 13.03; 6.375 90; 106.77; 90 | 720.971 | Hejny, C.; Sagl, R.; Tobbens, D. M.; Miletich, R.; Wildner, M.; Nasdala, L.; Ullrich, A.; Balic-Zunic T Crystal-structure properties and the molecular nature of hydrostatically compressed realgar Note: P = 1.55 GPa Physics and Chemistry of Minerals, 2012, 39, 399-412 |
| 9014680 | CIF | C4 H6 Ca O6 | P -1 | 5.9466; 10.2247; 16.6496 72.213; 79.718; 89.791 | 947.062 | Herdtweck, E.; Kornprobst, T.; Sieber, R.; Straver, L.; Plank, J. Crystal structure, synthesis, and properties of tri-calcium di-citrate tetra-hydrate [Ca3(C6H5O7)2(H2O)2]*2H2O Notwe: polymorph of earlandite Zeitschrift fur Anorganische und Allgemeine Chemie, 2011, 637, 655-659 |
| 9014682 | CIF | Bi O4 V | P n c a | 5.328; 5.052; 12.003 90; 90; 90 | 323.085 | Granzin, J.; Pohl, D. Refinement of pucherite, BiVO4 Zeitschrift fur Kristallographie, 1969, 169, 289-294 |
| 9014684 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.7993; 9.1491; 5.1991 90; 101.891; 90 | 456.122 | Redhammer, G. J.; Senyshyn, A.; Tippelt, G.; Pietzonka, C.; Treutmann, W.; Roth, G.; Amthauer, G. Magnetic and low-temperature structural behavior of clinopyroxene-type FeGeO3: A neutron diffraction, magnetic susceptibility, and Fe Mossbauer study T = 298 K American Mineralogist, 2012, 97, 694-706 |
| 9014685 | CIF | Al7 Ca2 H33 O39 P4 | P 3 2 1 | 6.988; 6.988; 16.707 90; 90; 120 | 706.537 | Mills, S. J.; Kampf, A. R.; Sejkora, J.; Adams, P. M.; Birch, W. D.; Plasil, J. Iangreyite: a new secondary phosphate mineral closely related to perhamite Mineralogical Magazine, 2011, 75, 327-336 |
| 9014688 | CIF | H12 O10 S Zn | C 1 2/c 1 | 9.9692; 7.2441; 24.2493 90; 98.488; 90 | 1732.05 | Anderson, J. L.; Peterson, R. C.; Swainson, I. The atomic structure of deuterated boyleite ZnSO4*4D2O, ilesite MnSO4*4D2O, and bianchite ZnSO4*6D2O American Mineralogist, 2012, 97, 1905-1914 |
| 9014689 | CIF | As0.154 Cu1.368 Fe2.148 H24 Mg0.222 Ni2.262 O24 Sb1.846 | P -3 | 5.3506; 5.3506; 19.5802 90; 90; 120 | 485.459 | Mills, S. J.; Kampf, A. R.; Housley, R. M.; Favreau, G.; Pasero, M.; Biagioni, C.; Merlino, S.; Berbain, C.; Orlandi, P. Omsite, (Ni,Cu)2Fe3+(OH)6[Sb(OH)6], a new member of the cualstibite group from Oms, France Mineralogical Magazine, 2012, 76, 1347-1354 |
| 9014690 | CIF | Ba0.276 Cu O10 Si4 Sr0.724 | P 4/n c c :2 | 7.37735; 7.37735; 15.7266 90; 90; 90 | 855.925 | Knight, K. S.; Henderson, C. M. B.; Clark, S. M. Structural variations in the wesselsite-effenbergerite (Sr1-xBaxCuSi4O10) solid solution Sample: x = .276 European Journal of Mineralogy, 2010, 22, 411-423 |
| 9014693 | CIF | Fe S4 Sb2 | P n a m | 11.2796; 13.9181; 3.7359 90; 90; 90 | 586.501 | Periotto, B.; Balic-Zunic T; Nestola, F. The role of the Sb3+ lone-electron pairs and Fe2+ coordination in the high-pressure behavior of berthierite Note: P = 1.41 GPa the Baia Mare metallogenic area, Romania The Canadian Mineralogist, 2012, 50, 201-218 |
| 9014695 | CIF | Cr O4 Sr | P 1 21/n 1 | 7.065; 7.375; 6.741 90; 103.08; 90 | 342.123 | Effenberger, H.; Pertlik, F. Four monazite type structures: comparison of SrCrO4, SrSeO4, PbCrO4 (crocoite), and PbSeO4 Zeitschrift für Kristallographie, 1986, 176, 75-83 |
| 9014699 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.5078; 11.5078; 11.5078 90; 90; 90 | 1523.97 | Nakatsuka, A.; Shimokawa, M.; Nakayama, N.; Ohtaka, O.; Arima, H.; Okube, M.; Yoshiasa, A. Static disorders of atoms and experimental determination of Debye temperature in pyrope: Low- and high-temperature single-crystal X-ray diffraction study Note: T = 773.1 K American Mineralogist, 2011, 96, 1593-1605 |
| 9014700 | CIF | Al H44 Na3 O50 V10 | P -1 | 8.668; 10.295; 12.908 105.826; 97.899; 103.385 | 1053.06 | Rakovan, J.; Schmidt, G. R.; Gunter, M. E.; Nash, B.; Marty, J.; Kampf, A. R.; Wise, W. S. Hughesite, Na3Al(V10O28)*22H2O, a new member of the pascoite family of minerals from the Sunday mine, San Miguel county, Colorado The Canadian Mineralogist, 2011, 49, 1253-1265 |
| 9014701 | CIF | C Ca O3 | C 1 2/c 1 | 12.17; 7.12; 9.47 90; 118.37; 90 | 722.026 | Mugnaioli, E.; Andrusenko, I.; Schuler, T.; Loges, N.; Dinnebier, R. E.; Panthofer, M.; Tremel, W.; Kolb, U. Ab-initio-Strukturbestimmung von Vaterit mit automatischer Beugungstomographie Angewandte Chemie, 2012, 124, 1-6 |
| 9014702 | CIF | C H O4 Sm | P n m a | 7.1388; 4.9151; 8.4717 90; 90; 90 | 297.254 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9014704 | CIF | Cl Cu2 H3 O3 | P 1 21/n 1 | 6.1675; 6.8327; 9.1517 90; 99.492; 90 | 380.379 | Malcherek, T.; Schluter, J. Structures of the pseudo-trigonal polymorphs of Cu2(OH)3Cl Note: Sample #1 Acta Crystallographica, Section B, 2009, 65, 334-341 |
| 9014705 | CIF | H5.5 Li Na1.5 O16 Si4 Ti2 | C 1 2/c 1 | 27.483; 8.669; 5.246 90; 90.782; 90 | 1249.74 | Yakovenchuk, V. N.; Ivanyuk, G. Y.; Krivovichev, S. V.; Pakhomovsky, Y. A.; Selivanova, E. A.; Korchak, J. A.; Men'shikov, Y. P.; Drogobuzhskaya, S. V.; Zalkind, O. A. Eliseevite, Na1.5Li[Ti2Si4O12.5(OH)1.5]*2H2O, a new microporous titanosilicate from the Lovozero alkaline massif (Kola Peninsula, Russia) Note y-coordinate for O3 changed from .218 to reproduce reported bond lengths American Mineralogist, 2011, 96, 1624-1629 |
| 9014706 | CIF | Al2 Cl H18 N4 Na O18 S4 | I 41/a c d :2 | 18.118; 18.118; 11.32 90; 90; 90 | 3715.93 | Demartin, F.; Gramaccioli, C. M.; Campostrini, I. Adranosite, (NH4)4NaAl2(SO4)4Cl(OH)2, a new ammonium sulfate chloride from La Fossa Crater, Vulcano, Aeolian Islands, Italy The Canadian Mineralogist, 2010, 48, 315-321 |
| 9014708 | CIF | Al2.796 K0.876 Na0.071 O14 S2 | R -3 m :H | 6.9935; 6.9935; 17.64 90; 90; 120 | 747.168 | Zema, M.; Callegari, A. M.; Tarantino, S. C.; Gasparini, E.; Ghigna, P. Thermal expansion of alunite up to dehydroxylation and collapse of the crystal structure Note: T = 500 C Mineralogical Magazine, 2012, 76, 613-623 |
| 9014709 | CIF | C H Eu O4 | P 21 21 21 | 7.1002; 4.8932; 8.453 90; 90; 90 | 293.68 | Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S. Crystal chemistry of RE(CO3)OH Zeitschrift fur Kristallographie, 2007, 222, 326-334 |
| 9014710 | CIF | Nb1.32 O18 Sb5 Ta1.28 Ti0.16 W1.24 | C 1 2/c 1 | 54.116; 4.9143; 5.5482 90; 90.425; 90 | 1475.46 | Hawthorne, F. C.; Cooper, M. A.; Ball, N. A.; Abdu, Y. A.; Cerny, P.; Camara, F.; Laurs, B. M. Billwiseite, ideally Sb3+5(Nb,Ta)3WO18, a new oxide mineral species from the Stak Nala Pegmatite, Nanga Parbat - Haramosh Massif, Pakistan: description and crystal structure The Canadian Mineralogist, 2012, 50, 805-814 |
| 9014712 | CIF | Cu3 H8 Mo O8 | P 1 21/m 1 | 9.9904; 5.9934; 5.5255 90; 97.428; 90 | 328.071 | Yang, H.; Jenkins, R. A.; Thompson, R. M.; Downs, R. T.; Evans, S. H.; Bloch, E. M. Markascherite, Cu3(MoO4)(OH)4, a new mineral species polymorphic with szenicsite, from Copper Creek, Pinal County, Arizona, U.S.A. American Mineralogist, 2012, 97, 197-202 |
| 9014713 | CIF | B8 Cl14 H4 Mn2 O45 Pb36 | P m m n :2 | 12.759; 27.169; 11.515 90; 90; 90 | 3991.67 | Siidra, O. I.; Krivovichev, S. V.; Turner, R. W.; Rumsey, M. S.; Spratt, J. Crystal chemistry of layered Pb oxychloride minerals with PbO-related structures: Part II. Crystal structure of vladkrivovichevite, [Pb32O18][Pb4Mn2O]Cl14(BO3)8*2H2O American Mineralogist, 2013, 98, 256-261 |
| 9014714 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8355; 7.6102; 9.6317 90; 90.15; 90 | 354.437 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
| 9014715 | CIF | Al1.61 Fe0.391 Mg0.999 O4 | F d -3 m :2 | 8.147; 8.147; 8.147 90; 90; 90 | 540.746 | Princivalle, F.; Martignago, F.; Nestola, F.; Dal Negro, A. Kinetics of cation ordering in synthetic Mg(Al,Fe3+)2O4 spinels Note Sample F39, disordered at 1000 C for 24 h, then ordered at 750 C Annealing time = 6 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9014716 | CIF | Cl Cu H O | P 1 21/a 1 | 5.555; 6.671; 6.127 90; 114.88; 90 | 205.978 | Effenberger, H. Verfeinerung der Kristallstruktur von Kupfer(II)-hydroxichlorid, Cu(OH)Cl Monatshefte fur Chemie, 1984, 115, 725-730 |
| 9014717 | CIF | Al1.462 Fe0.537 Mg O4 | F d -3 m :2 | 8.169; 8.169; 8.169 90; 90; 90 | 545.138 | Princivalle, F.; Martignago, F.; Nestola, F.; Dal Negro, A. Kinetics of cation ordering in synthetic Mg(Al,Fe3+)2O4 spinels Note Sample F54, disordered at 1000 C for 24 h, then ordered at 650 C Annealing time = 93 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9014718 | CIF | O3 Sb | P 1 21/n 1 | 5.2526; 4.7331; 8.6322 90; 90.8; 90 | 214.585 | Fourquet, J.; Gillet, P.; Le Bail, A. Li/H topotactic exchange on LiSbO3: The series Li(1-x)HxSbO3 (0<=x<=1). _cod_database_code 1000143 Materials Research Bulletin, 1989, 24, 1207-1214 |
| 9014719 | CIF | Cl2 Co | R -3 m :H | 3.553; 3.553; 17.359 90; 90; 120 | 189.778 | Wilkinson, M. K.; Cable, J. W.; Wollan, E. O.; Koehler, W. C. Neutron diffraction investigations of the magnetic ordering in FeBr2, CoBr2, FeCl2, and CoCl2 Physical Review, 1959, 113, 497-507 |
| 9014721 | CIF | Al2.5 Ca0.773 H5.66 Na0.7 O12.83 Si2.5 | P b m n | 13.0809; 13.0597; 6.6051 90; 90; 90 | 1128.37 | Gatta, G. D.; Kahlenberg, V.; Kaindl, R.; Rotiroti, N.; Cappelletti, P.; de Gennaro, M. Crystal structure and low-temperature behavior of "disordered" thomsonite T = 295.5 K American Mineralogist, 2010, 95, 495-502 |
| 9014722 | CIF | C0.736 H1.998 Al2.79 Ca0.27 Na3.7 O15.207 Si3.21 | P 63 | 12.618; 12.618; 5.116 90; 90; 120 | 705.411 | Pekov, I. V.; Olysych, L. V.; Chukanov, N. V.; Zubkova, N. V.; Pushcharovsky D Yu; Van, K. V.; Giester, G.; Tillmanns, E. Crystal chemistry of cancrinite-group minerals with an AB-type framework: A review and new data. I. Chemical and structural variations Note: Sample# 11/1 The Canadian Mineralogist, 2012, 49, 1129-1150 |
| 9014723 | CIF | H12 Mg3.592 O22 Si6 | P n c n | 13.3067; 26.972; 5.2664 90; 90; 90 | 1890.16 | Sanchez, M.; Garcia-Romero E; Suarez, M.; Silva, I.; Fuentes-Montero L; Martinez-Criado G Variability in sepiolite: Diffraction studies Note: Sample BAT25 Note: T = 25 C American Mineralogist, 2011, 96, 1443-1454 |
| 9014724 | CIF | Al7.317 B3 Ca0.695 F0.678 Fe0.057 H3.51 Li1.569 Mg0.021 Mn0.033 Na0.24 O30.51 Pb0.007 Si6 Ti0.003 | R 3 m :H | 15.8299; 15.8299; 7.1009 90; 90; 120 | 1540.99 | Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S. Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L23, disordered model The Canadian Mineralogist, 2011, 49, 63-88 |
| 9014725 | CIF | Fe2 H6 O13 S Te2 | P 21 n b | 9.6967; 14.2676; 7.8748 90; 90; 90 | 1089.47 | Kampf, A. R.; Mills, S. J. The role of hydrogen in tellurites: crystal structure refinements of juabite, poughite and rodalquilarite Journal of Geosciences, 2011, 56, 235-247 |
| 9014726 | CIF | H5.38 Na1.581 O17.69 Rb0.2 Si6 Zr | P b c m | 7.128; 14.644; 14.642 90; 90; 90 | 1528.37 | Grigor'eva, A. A.; Zubkova, N. V.; Pekov, I. V.; Kolitsch, U.; Pushcharovsky, D. Y.; Vigasina, M. F.; Giester, G.; Dordevic, T.; Tillmanns, E.; Chukanov, N. V. Crystal chemistry of elpidite from Kahn Bogdo (Mongolia) and its K- and Rb-exchanged forms Note: Rb-exchanged at 90 deg C Crystallography Reports, 2011, 56, 832-841 |
| 9014728 | CIF | C Fe O3 | R -3 c :H | 4.637; 4.637; 14.98 90; 90; 120 | 278.944 | Lavina, B.; Dera, P.; Downs, R. T.; Yang, W.; Sinogeikin, S.; Meng, Y.; Shen, G.; Schiferl, D. Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition Note: run P4, P = 7.31 GPa Physical Review B, 2010, 82, 064110-064118 |
| 9014729 | CIF | Al3 Ca2 H O13 Si3 | P n m a | 16.176; 5.5342; 10.0007 90; 90; 90 | 895.275 | Alvaro, M.; Angel, R. J.; Camara, F. High-pressure behavior of zoisite Note: P = 1.144 GPa American Mineralogist, 2012, 97, 1165-1176 |
| 9014730 | CIF | K2 Mg2 O12 S3 | P 21 3 | 9.919; 9.919; 9.919 90; 90; 90 | 975.896 | Mereiter, K. Refinement of the crystal structure of langbeinite, K2Mg2(SO4)3 Neues Jahrbuch fur Mineralogie, Monatshefte, 1979, 1979, 182-188 |
| 9014732 | CIF | Fe Nb0.13 O6 Ta1.87 | P 42/m n m | 4.7533; 4.7533; 9.2773 90; 90; 90 | 209.61 | Zema, M.; Tarantino, S. C.; Giorgiani, A. Structural changes induced by cation ordering in ferrotapiolite Note: Crystal Kim5_q0, untreated Mineralogical Magazine, 2006, 70, 319-328 |
| 9014734 | CIF | Al1.356 Be3 Fe0.384 H10.944 Mg0.258 Na0.432 O18.912 Si6 | P 6/m c c | 9.258; 9.258; 9.156 90; 90; 120 | 679.627 | Groat, L. A.; Rossman, G. R.; Dyar, M. D.; Turner, D.; Piccoli, P. M. B.; Schultz, A. J.; Ottolini, L. Crystal chemistry of dark blue aquamarine from the True Blue showing, Yukon Territory, Canada Note: neutron The Canadian Mineralogist, 2010, 48, 597-613 |
| 9014735 | CIF | Al2 Co0.5 O4 Zn0.5 | F d -3 m :2 | 8.09491; 8.09491; 8.09491 90; 90; 90 | 530.44 | Ardit, M.; Cruciani, G.; Dondi, M. Structural relaxation in tetrahedrally coordinated Co2+ along the gahnite-Co-aluminate spinel solid solution Note: inversion parameter = 0.035, Co content = 0.50 apfu American Mineralogist, 2012, 97, 1394-1401 |
| 9014736 | CIF | C O6 Pb2 S2 | P n m a | 16.326; 8.773; 4.583 90; 90; 90 | 656.414 | Bindi, L.; Nestola, F.; Kolitsch, U.; Guastoni, A.; Zorzi, F. Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-03 Baden-Wurttemberg, Germany Mineralogical Magazine, 2011, 75, 2721-2732 |
| 9014738 | CIF | Bi0.36 Ca0.19 Cu H0.64 O4.93 Pb0.43 V | P n a m | 7.486; 9.62; 5.881 90; 90; 90 | 423.522 | Krause, W.; Kolitsch, U.; Bernhardt, H. J.; Effenberger, H. Duhamelite discredited Neues Jahrbuch fur Mineralogie, Monatshefte, 2003, 2003, 75-96 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!