Crystallography Open Database

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9016913 CIFCa H17 O25.5 Si5 U2P b c n18.3; 14.2331; 17.9192
90; 90; 90		4667.34Plasil, J.; Fejfarova, K.; Cejka, J.; Dusek, M.; Skoda, R.; Sejkora, J.
Revision of the crystal structure and chemical formula of haiweeite, Ca(UO2)2(Si5O12)(OH)2*6H2O
American Mineralogist, 2013, 98, 718-723
9016471 CIFCa8 O18 Si5P b c n5.0851; 11.4165; 28.6408
90; 90; 90		1662.71Galuskin, E. V.; Gfeller, F.; Savelyeva, V. B.; Armbruster, T.; Lazic, B.; Galuskina, I. O.; Tobbens, D. M.; Zadov, A. E.; Dzierzanowski, P.; Pertsev, N. N.; Gazeev, V. M.
Pavlovskyite Ca8(SiO4)2(Si3O10): a new mineral of altered silicate-carbonate xenoliths from the two Russian type localities, Birkhin massif, Baikal Lake area and Upper Chegem caldera, North Caucasus
American Mineralogist, 2012, 97, 503-512
9016333 CIFO6 Ta Ti YbP b c n14.5478; 5.5289; 5.1683
90; 90; 90		415.704Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9015462 CIFHo O6 Ta TiP b c n14.6236; 5.5637; 5.203
90; 90; 90		423.323Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9015174 CIFFe Nb1.2 O6 Ta0.8P b c n14.2737; 5.73543; 5.0554
90; 90; 90		413.864dos Santos, C. A.; Zawislak, L. I.; Kinast, E. J.; Antonietti, V.; da Cunha, J. B. M.
Crystal chemistry and structure of the orthorhombic (Fe,Mn)(Ta,Nb)2O6 family of compounds Note: Sample Fe(Ta0.4Nb0.6)2O6
Brazilian Journal of Physics, 2001, 31, 616-631
9014551 CIFLu O6 Ta TiP b c n14.5288; 5.5226; 5.1572
90; 90; 90		413.797Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9014442 CIFO6 Ta Ti TmP b c n14.5706; 5.5339; 5.1832
90; 90; 90		417.933Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9014279 CIFFe0.09 Mn0.88 Nb0.28 O6 Ta1.72P b c n14.3196; 5.7413; 5.0624
90; 90; 90		416.196dos Santos, C. A.; Zawislak, L. I.; Kinast, E. J.; Antonietti, V.; da Cunha, J. B. M.
Crystal chemistry and structure of the orthorhombic (Fe,Mn)(Ta,Nb)2O6 family of compounds Note: Sample Mn0.88Fe0.09Ta1.72Nb0.28O6
Brazilian Journal of Physics, 2001, 31, 616-631
9013675 CIFH2 O5.5 Pb Si2P b c n13.2083; 9.7832; 8.6545
90; 90; 90		1118.33Kampf, A. R.; Rossman, G. R.; Housley, R. M.
Plumbophyllite, a new species from the Blue Bell claims near Baker, San Bernardino County, California Locality: Blue Bell claims near Baker, San Bernardino County, California, USA
American Mineralogist, 2009, 94, 1198-1204
9013659 CIFMg O3 SiP b c n9.177; 8.816; 4.812
90; 90; 90		389.312Jahn, S.; Martonak, R.
Phase behavior of protoenstatite at high pressure studied by atomistic simulations Locality: theoretical structure Note: modelled high-pressure phase at P = 0 GPa
American Mineralogist, 2009, 94, 950-956
9013658 CIFMg O3 SiP b c n9.171; 8.513; 5.254
90; 90; 90		410.194Jahn, S.; Martonak, R.
Phase behavior of protoenstatite at high pressure studied by atomistic simulations Locality: theoretical structure
American Mineralogist, 2009, 94, 950-956
9013115 CIFFe1.345 Mn0.559 Nb1.691 O10 Sn0.016 Ta0.351 Ti0.102 W0.919P b c n23.706; 5.723; 5.045
90; 90; 90		684.452Zhizhong, P.; Su, W.; Zhesheng, M.; Guangming, Y.
The crystal structure of qitianlingite (Fe2Nb2WO10)
Kexue Tongbao, 1988, 33, 856-861
9012334 CIFS20P b c n18.58; 13.181; 8.6
90; 90; 90		2106.17Schmidt, V. M.; Wilhelm, E.; Debaerdemaeker, T.; Hellner, E.; Kutoglu, A.
Darstellung und kristallstruktur von cyclooktadekaschwefel, S18, und cycloikosaschwefel, S20 Note: structure for S20
Zeitschrift fur Anorganische und Allgemeine Chemie, 1974, 405, 153-162
9012269 CIFP Pd SeP b c n13.594; 5.8317; 5.8583
90; 90; 90		464.423Foecker, A. J.; Jeitschko, W.
The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te)
Journal of Solid State Chemistry, 2001, 162, 69-78
9012222 CIFMg Nb2 O6P b c n14.1875; 5.7001; 5.0331
90; 90; 90		407.028Pagola, S.; Carbonio, R. E.; Alonso, J. A.; Fernandez-Diaz M T
Crystal structure refinement of Mg Nb2 O6 columbite from neutron powder diffraction data and study of the ternary system MgO-Nb2O5-NbO, with evidence of formation of new reduced pseudobrookite Mg5-xNb4+xO15-d (1.14<x<1.60) phases Locality: synthetic Note: reported and calculated Biso(O2)'s do not match
Journal of Solid State Chemistry, 1997, 134, 76-84
9011955 CIFC Ca2 F2 O3P b c n7.65; 7.55; 6.548
90; 90; 90		378.196Leufer, U.; Tillmanns, E.
Die kristallstruktur von brenkit, Ca2F2CO3
Tschermaks Mineralogische und Petrographische Mitteilungen, 1980, 27, 261-266
9011434 CIFNb O6 Ti YP b c n14.6432; 5.5528; 5.1953
90; 90; 90		422.434Weitzel, H.; Schrocke, H.
Kristallstrukturverfeinerungen von euxenit, Y(Nb0.5Ti0.5)2O6, und M-fergusonit, YNbO4
Zeitschrift fur Kristallographie, 1980, 152, 69-82
9011298 CIFH34 O40 U8P b c n14.6861; 13.9799; 16.7063
90; 90; 90		3429.97Weller, M. T.; Light, M. E.; Gelbrich, T.
Structure of uranium (VI) oxide dihydrate UO3*2H2O; synthetic meta-schoepite (UO2)4O(OH)6*5H2O Sample: T = 150 K
Acta Crystallographica, Section B, 2000, 56, 577-583
9010854 CIFO2 Ti0.666 Zr0.334P b c n4.7112; 5.4944; 4.9962
90; 90; 90		129.328Troitzsch, U.; Christy, A. G.; Ellis, D. J.
The crystal structure of disordered (Zr,Ti)O2 solid solution Sample: XTi = 0.666
Physics and Chemistry of Minerals, 2005, 32, 504-514
9010853 CIFO2 Ti0.65 Zr0.35P b c n4.72; 5.5078; 5.0018
90; 90; 90		130.031Troitzsch, U.; Christy, A. G.; Ellis, D. J.
The crystal structure of disordered (Zr,Ti)O2 solid solution Sample: XTi = 0.650
Physics and Chemistry of Minerals, 2005, 32, 504-514
9010852 CIFO2 Ti0.6 Zr0.4P b c n4.7447; 5.4925; 5.0119
90; 90; 90		130.611Troitzsch, U.; Christy, A. G.; Ellis, D. J.
The crystal structure of disordered (Zr,Ti)O2 solid solution Sample: XTi = 0.600
Physics and Chemistry of Minerals, 2005, 32, 504-514
9010851 CIFO2 Ti0.548 Zr0.452P b c n4.7762; 5.501; 5.0253
90; 90; 90		132.034Troitzsch, U.; Christy, A. G.; Ellis, D. J.
The crystal structure of disordered (Zr,Ti)O2 solid solution Sample: XTi = 0.548
Physics and Chemistry of Minerals, 2005, 32, 504-514
9010850 CIFO2 Ti0.5 Zr0.5P b c n4.8069; 5.4785; 5.0339
90; 90; 90		132.566Troitzsch, U.; Christy, A. G.; Ellis, D. J.
The crystal structure of disordered (Zr,Ti)O2 solid solution Sample: XTi = 0.500
Physics and Chemistry of Minerals, 2005, 32, 504-514
9010849 CIFO2 Ti0.45 Zr0.55P b c n4.8349; 5.4801; 5.0439
90; 90; 90		133.642Troitzsch, U.; Christy, A. G.; Ellis, D. J.
The crystal structure of disordered (Zr,Ti)O2 solid solution Sample: XTi = 0.450
Physics and Chemistry of Minerals, 2005, 32, 504-514
9010848 CIFO2 Ti0.425 Zr0.575P b c n4.8495; 5.4635; 5.0462
90; 90; 90		133.7Troitzsch, U.; Christy, A. G.; Ellis, D. J.
The crystal structure of disordered (Zr,Ti)O2 solid solution Sample: XTi = 0.425
Physics and Chemistry of Minerals, 2005, 32, 504-514
9010673 CIFAl F3 K2 O4 SP b c n10.81; 8.336; 6.822
90; 90; 90		614.745Demartin, F.; Gramaccioli, C. M.; Campostrini, I.; Orlandi, P.
Thermessaite, K2[AlF3|SO4], a new ino-aluminofluoride-sulfate from La Fossa crater, Vulcano, Aeolian Islands, Italy Locality: La Fossa crater, Vulcano, Aeolian Islands, Italy Note: z-coordinate of S altered
The Canadian Mineralogist, 2008, 46, 693-700
9010405 CIFAl2 O9 Pb2 Si2P b c n6.8981; 10.6906; 9.7413
90; 90; 90		718.37Dorsam, G.; Liebscher, A.; Wunder, B.; Franz, G.
Crystal structures of synthetic melanotekite (Pb2Fe2Si2O9), kentrolite (Pb2Mn2Si2O9), and the aluminum analogue (Pb2Al2Si2O9)
American Mineralogist, 2008, 93, 573-583
9010403 CIFFe2 O9 Pb2 Si2P b c n6.9788; 11.0164; 10.0881
90; 90; 90		775.586Dorsam, G.; Liebscher, A.; Wunder, B.; Franz, G.
Crystal structures of synthetic melanotekite (Pb2Fe2Si2O9), kentrolite (Pb2Mn2Si2O9), and the aluminum analogue (Pb2Al2Si2O9)
American Mineralogist, 2008, 93, 573-583
9010198 CIFH34 Na0.47 O37.082 U8P b c n14.6592; 14.0358; 16.7148
90; 90; 90		3439.13Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.
Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-AB2
American Mineralogist, 2007, 92, 662-669
9010197 CIFH34 Na1.16 O37.9 U8P b c n14.6317; 14.0147; 16.6977
90; 90; 90		3424.01Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.
Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-AB1
American Mineralogist, 2007, 92, 662-669
9010196 CIFH32 Na1.22 O39.09 U8P b c n14.6401; 14.0417; 16.7044
90; 90; 90		3433.96Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.
Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-CRY-Np
American Mineralogist, 2007, 92, 662-669
9010195 CIFH32 Na1.09 O38.328 U8P b c n14.705; 14.0565; 16.7051
90; 90; 90		3452.96Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.
Neptunium incorporation in sodium-substituted metaschoepite Sample: Na-Ms-CRY
American Mineralogist, 2007, 92, 662-669
9010194 CIFH34 Na0.48 O37.91 U8P b c n14.6801; 14.0287; 16.7196
90; 90; 90		3443.28Klingensmith, A. L.; Deely, K. M.; Kinman, W. S.; Kelly, V.; Burns, P. C.
Neptunium incorporation in sodium-substituted metaschoepite Sample: Natural
American Mineralogist, 2007, 92, 662-669
9009277 CIFCa0.5 H2 O5 P ZnP b c n17.16399; 7.415; 6.673
90; 90; 90		849.279Hill, R. J.; Johnson, J. E.; Jones, J. B.
Scholzite and other phosphate minerals from Reaphook Hill, South Australia
Neues Jahrbuch fur Mineralogie, Monatshefte, 1973, 1973, 1-8
9009242 CIFC O2P b c n4.3441; 6.111; 4.285
90; 90; 90		113.753Park, J. H.; Yoo, C. S.; Iota, V.; Cynn, H.; Nicol, M. F.; Le Bihan, T.
Crystal structure of bent carbon dioxide phase IV Sample: P = 15 GPa, the authors think this structure is correct
Physical Review B, 2003, 68, 014107-014107
9009092 CIFO2 ReP b c n4.8094; 5.6433; 4.6007
90; 90; 90		124.867Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York
Crystal Structures, 1963, 1, 239-444
9009091 CIFO2 PbP b c n4.947; 5.951; 5.497
90; 90; 90		161.829Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: known as alpha-PbO2
Crystal Structures, 1963, 1, 239-444
9008307 CIFO2 Ti0.67 Zr0.33P b c n4.706; 5.553; 5.024
90; 90; 90		131.289Willgallis, A.; Hartl, H.
(Zr0.33Ti0.67)O2 - ein naturliches zirkonium-titanoxid mit alpha-PbO2-struktur Locality: Rakwana, Sri Lanka
Zeitschrift fur Kristallographie, 1983, 164, 59-66
9007999 CIFMg O5 Te2P b c n7.2391; 10.658; 5.988
90; 90; 90		462Weil, M.
Redetermination of MgTe2O5
Acta Crystallographica, Section E, 2005, 61, i237-i239
9007921 CIFMn O5 Te2P b c n7.3114; 10.9216; 6.1711
90; 90; 90		492.776Johnston, M. G.; Harrison, W. T. A.
Manganese tellurite, beta-MnTe2O5
Acta Crystallographica, Section E, 2002, 58, i59-i61
9007747 CIFLi2 O5 Si2P b c n5.683; 4.784; 14.648
90; 90; 90		398.242Smith, R. I.; Howie, R. A.; West, A. R.; Aragon-Pina A; Villafuerte-Castrejon M E
The structure of metastable lithium disilicate, Li2Si2O5
Acta Crystallographica, Section C, 1990, 46, 363-365
9007495 CIFMn Nb O6 TaP b c n14.418; 5.76; 5.099
90; 90; 90		423.46Klein, S.; Weitzel, H.
Magnetische struktur von Mn(Nb0.5Ta0.5)2O6, manganotantalit Note: columbite structure
Acta Crystallographica, Section A, 1976, 32, 587-591
9007492 CIFRh2 S3P b c n8.462; 5.985; 6.138
90; 90; 90		310.859Parthe, E.; Hohnke, D.; Hulliger, F.
A new structure type with octahedron pairs for Rh2S3,Rh2Se3 and Ir2S3
Acta Crystallographica, 1967, 23, 832-840
9007256 CIFCa0.009 Fe0.138 Mn0.792 Nb1.794 O6 Sc0.002 Sn0.003 Ta0.166 Ti0.077 W0.001P b c n14.4508; 5.7741; 5.1025
90; 90; 90		425.754Tarantino S C; Zema M; Pistorino M; Domeneghetti M C
High-temperature X-ray investigation of natural columbites Note: sample KRA5 at T = 600 C Sample: Kragero, Norway
Physics and Chemistry of Minerals, 2003, 30, 590-598
9007255 CIFCa0.009 Fe0.138 Mn0.792 Nb1.794 O6 Sc0.002 Sn0.003 Ta0.166 Ti0.077 W0.001P b c n14.4159; 5.7593; 5.0905
90; 90; 90		422.641Tarantino S C; Zema M; Pistorino M; Domeneghetti M C
High-temperature X-ray investigation of natural columbites Note: sample KRA5 at T = 300 C Locality: Kragero, Norway
Physics and Chemistry of Minerals, 2003, 30, 590-598
9007254 CIFCa0.009 Fe0.138 Mn0.792 Nb1.794 O6 Sc0.002 Sn0.003 Ta0.166 Ti0.077 W0.001P b c n14.386; 5.7478; 5.0797
90; 90; 90		420.029Tarantino S C; Zema M; Pistorino M; Domeneghetti M C
High-temperature X-ray investigation of natural columbites Note: sample KRA5 at T = 20 C Locality: Kragero, Norway
Physics and Chemistry of Minerals, 2003, 30, 590-598
9007253 CIFCa0.001 Fe0.747 Mn0.215 Nb1.894 O6 Sc0.003 Sn0.001 Ta0.094 Ti0.027 W0.003P b c n14.3515; 5.761; 5.0833
90; 90; 90		420.282Tarantino S C; Zema M; Pistorino M; Domeneghetti M C
High-temperature X-ray investigation of natural columbites Note: sample BRA3 at T = 600 C Locality: San Jose de Safira, Minas Gerais, Brazil
Physics and Chemistry of Minerals, 2003, 30, 590-598
9007252 CIFCa0.001 Fe0.747 Mn0.215 Nb1.894 O6 Sc0.003 Sn0.001 Ta0.094 Ti0.027 W0.003P b c n14.3191; 5.7482; 5.0713
90; 90; 90		417.414Tarantino S C; Zema M; Pistorino M; Domeneghetti M C
High-temperature X-ray investigation of natural columbites Note: sample BRA3 at T = 300 C Locality: San Jose de Safira, Minas Gerais, Brazil
Physics and Chemistry of Minerals, 2003, 30, 590-598
9007251 CIFCa0.001 Fe0.747 Mn0.215 Nb1.894 O6 Sc0.003 Sn0.001 Ta0.094 Ti0.027 W0.003P b c n14.288; 5.7364; 5.0562
90; 90; 90		414.415Tarantino S C; Zema M; Pistorino M; Domeneghetti M C
High-temperature X-ray investigation of natural columbites Note: sample BRA3 at T = 20 C Locality: San Jose de Safira, Minas Gerais, Brazil
Physics and Chemistry of Minerals, 2003, 30, 590-598
9006342 CIFMg O3 SiP b c n9.315; 8.899; 5.365
90; 90; 90		444.727Yang, H.; Ghose, S.
High temperature single crystal X-ray diffraction studies of the ortho-proto phase transition in enstatite, Mg2Si2O6 at 1360 K Sample: T = 1400 K
Physics and Chemistry of Minerals, 1995, 22, 300-310

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