Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9009801 | CIF | S8 | P 1 2/n 1 | 8.163; 13.04; 8.386 90; 112.78; 90 | 823.024 | Krauter, T.; Neumuller, B. Reaktionen von diorganogallium(indium)fluoriden. Die kristallstrukture von Mes2InF Note: known as gamma sulfur Zeitschrift fur Anorganische und Allgemeine Chemie, 1995, 621, 597-606 |
| 9009802 | CIF | Cs0.601 F2 Li0.602 Mg2.398 O10 Si4 | C 1 2/m 1 | 5.2401; 9.0942; 10.7971 90; 99.21; 90 | 507.897 | Breu J; Seidl W; Stoll A Disorder in smectites in dependence of the interlayer cation Note: hectorite structure Note: anisoU's taken from ICSD Zeitschrift fur Anorganische und Allgemeine Chemie, 2003, 629, 503-515 |
| 9009803 | CIF | As2 O5 | P 41 21 2 | 8.572; 8.572; 4.636 90; 90; 90 | 340.649 | Jansen, M. On a new modification of As2O5 Note: Sample at T = 310 C Zeitschrift fur Naturforschung B, 1979, 34, 10-13 |
| 9009804 | CIF | Cl16 H14 O20 Sn21 | R 3 2 :H | 10.018; 10.018; 44.03 90; 90; 120 | 3826.85 | Schnering, H. G.; Nesper, R.; Pelshenke, H. Sn21Cl16(OH)14O6, das sogenannte basische zinn(II)-clorid Zeitschrift fur Naturforschung B, 1981, 36, 1551-1560 |
| 9009805 | CIF | As O4 P | P n m a | 8.4315; 5.0229; 7.2039 90; 90; 90 | 305.089 | Bodenstein, D.; Brehm, A.; Jones, P. G.; Schwarzmann, E.; Sheldrick, G. M. Preparation and crystal structure of arsenic(III) phosphorus(V) oxide, AsPO4 Zeitschrift fur Naturforschung B, 1982, 37, 136-137 |
| 9009806 | CIF | As3 H O6 | P 1 21/c 1 | 12.504; 4.593; 10.976 90; 118.08; 90 | 556.162 | Bodenstein, D.; Brehm, A.; Jones, P. G.; Schwarzmann, E.; Sheldrick, G. M. Darstellung und kristallstruktur von arsen(III)arsen(V)oxidhydroxid As3O5(OH) Zeitschrift fur Naturforschung B, 1982, 37, 138-140 |
| 9009807 | CIF | As O3 Sb | P 1 21/n 1 | 4.58; 13.16; 5.44 90; 95; 90 | 326.636 | Bodenstein, D.; Brehm, A.; Jones, P. G.; Schwarzmann, E.; Sheldrick, G. M. Darstellung und kristallstruktur von monoklinem arsen(III)antimon(III)oxid, AsSbO3 Zeitschrift fur Naturforschung B, 1983, 38, 901-904 |
| 9009808 | CIF | Al2 H5 K O11 P2 | P 1 21/n 1 | 9.499; 9.503; 9.535 90; 103.26; 90 | 837.768 | Dick, S. Uber die struktur von synthetischem tinsleyit K[Al2(PO4)2(OH)(H2O)]*(H2O) Zeitschrift fur Naturforschung B, 1999, 54, 1385-1390 |
| 9009809 | CIF | Mg2 O4 V1.333 | F d -3 m :2 | 8.409; 8.409; 8.409 90; 90; 90 | 594.611 | Wang, X.; Zhang, H.; Sinkler, W.; Poeppelmeier, K. R.; Marks, L. D. Reduction of magnesium orthovanadate Mg2(VO4)2 Journal of Alloys and Compounds, 1998, 270, 88-94 |
| 9009810 | CIF | O4 Rh2 Sr0.375 | I 1 2/m 1 | 10.4399; 3.0626; 9.2135 90; 95.262; 90 | 293.344 | Plaisier, J. R.; Van Vliet, A. A. C.; IJdo D J W Synthesis, structure and magnetic properties of a new hollandite: Sr0.75Rh4O8 Note: Hollandite-type structure Journal of Alloys and Compounds, 2001, 314, 56-61 |
| 9009811 | CIF | O4 Pb W | I 41/a :2 | 5.46979; 5.46979; 12.06339 90; 90; 90 | 360.92 | Chipaux, R.; Andre, G.; Cousson, A. Crystal structure of lead tungstate at 1.4 and 300 K Sample: .Top. at T = 290 K Note: Scheelite structure Journal of Alloys and Compounds, 2001, 325, 91-94 |
| 9009812 | CIF | O4 Pb W | I 41/a :2 | 5.46462; 5.46462; 12.04787 90; 90; 90 | 359.774 | Chipaux, R.; Andre, G.; Cousson, A. Crystal structure of lead tungstate at 1.4 and 300 K Sample: Bottom, T = 290 K Note: Scheelite structure Journal of Alloys and Compounds, 2001, 325, 91-94 |
| 9009813 | CIF | O4 Pb W | I 41/a :2 | 5.43241; 5.43241; 12.04817 90; 90; 90 | 355.554 | Chipaux, R.; Andre, G.; Cousson, A. Crystal structure of lead tungstate at 1.4 and 300 K Sample: Yellow, T = 290 K Note: Scheelite structure Journal of Alloys and Compounds, 2001, 325, 91-94 |
| 9009814 | CIF | O4 Pb W | I 41/a :2 | 5.45961; 5.45961; 12.00222 90; 90; 90 | 357.754 | Chipaux, R.; Andre, G.; Cousson, A. Crystal structure of lead tungstate at 1.4 and 300 K Sample: Top, T = 1.4 K Note: Scheelite structure Journal of Alloys and Compounds, 2001, 325, 91-94 |
| 9009815 | CIF | O4 Pb W | I 41/a :2 | 5.45565; 5.45565; 11.9923 90; 90; 90 | 356.94 | Chipaux, R.; Andre, G.; Cousson, A. Crystal structure of lead tungstate at 1.4 and 300 K Sample: Bottom, T = 1.4 K Note: Scheelite structure Journal of Alloys and Compounds, 2001, 325, 91-94 |
| 9009816 | CIF | Br Hg3 I Te2 | C 1 2 1 | 18.376; 9.587; 10.575 90; 90.12; 90 | 1863 | Minets, Y. V.; Voroshilov, Y. V.; Pan'ko, V. V. The structures of mercury chalcogenhalogenides Hg3X2Hal2 Journal of Alloys and Compounds, 2004, 367, 109-114 |
| 9009817 | CIF | Br3 Hg6 I S4 | P 4 21 2 | 13.32; 13.32; 4.465 90; 90; 90 | 792.191 | Minets, Y. V.; Voroshilov, Y. V.; Pan'ko, V. V. The structures of mercury chalcogenhalogenides Hg3X2Hal2 Note: synthetic, superstructure Journal of Alloys and Compounds, 2004, 367, 109-114 |
| 9009818 | CIF | Au0.75 Hg0.25 | P 63/m m c | 2.918; 2.918; 4.8113 90; 90; 120 | 35.478 | Rolfe, C.; Hume-Rothery W The constitution of alloys of gold and mercury Journal of the Less-Common Metals, 1967, 13, 1-10 |
| 9009819 | CIF | Pd16 S7 | I -4 3 m | 8.93; 8.93; 8.93 90; 90; 90 | 712.122 | Matkovic, P.; El Boragy, M.; Schubert, K. Kristallstruktur von Pd16S7 Journal of the Less-Common Metals, 1976, 50, 165-176 |
| 9009820 | CIF | Pd | F m -3 m | 3.893; 3.893; 3.893 90; 90; 90 | 59 | Ellner, M. Zusammenhang zwischen strukturellen und thermodynamischen eigenschaften bei phasen der kupferfamilie in T10-B4-systemen Note: sample is synthetic Journal of the Less-Common Metals, 1981, 78, 21-32 |
| 9009821 | CIF | Pd Sn3 | P m -3 m | 3.976; 3.976; 3.976 90; 90; 90 | 62.855 | Ellner, M. Zusammenhang zwischen strukturellen und thermodynamischen eigenschaften bei phasen der kupferfamilie in T10-B4-systemen Note: sample is synthetic Journal of the Less-Common Metals, 1981, 78, 21-32 |
| 9009822 | CIF | Cu H2 O6 Pb S | P 1 21/m 1 | 9.701; 5.65; 4.69 90; 102.65; 90 | 250.822 | Effenberger, H. Crystal structure and chemical formula of schmiederite, Pb2Cu2(OH)4(SeO3)(SeO4), with a comparison to linarite PbCu(OH)2(SO4) Mineralogy and Petrology, 1987, 36, 3-12 |
| 9009823 | CIF | Cu2 H4 O11 Pb2 Se2 | P 1 21/m 1 | 9.922; 5.712; 9.396 90; 101.96; 90 | 520.954 | Effenberger, H. Crystal structure and chemical formula of schmiederite, Pb2Cu2(OH)4(SeO3)(SeO4), with a comparison to linarite PbCu(OH)2(SO4) Mineralogy and Petrology, 1987, 36, 3-12 |
| 9009824 | CIF | As2 Cl5 Cu O9 Pb8 | C 1 2/m 1 | 13.578; 20.099; 7.465 90; 105.73; 90 | 1960.94 | Pertlik, F. The structure of freedite, Pb8Cu(AsO3)2O3Cl5 Mineralogy and Petrology, 1987, 36, 85-92 |
| 9009825 | CIF | Fe3 H8 Na O14 P2 | P 41 21 2 | 7.313; 7.313; 19.315 90; 90; 90 | 1032.97 | Cozzupoli, D.; Grubessi, O.; Mottana, A.; Zanazzi, P. F. Cyrilovite from Italy: structure and crystal chemistry Mineralogy and Petrology, 1987, 37, 1-14 |
| 9009826 | CIF | Ca4.74 F2.5 Na1.38 O15.5 Si4 Y0.88 Zr | P -1 | 11.012; 10.342; 7.359 89.92; 109.21; 90.06 | 791.421 | Merlino, S.; Perchiazzi, N. The crystal structure of hiortdahlite II Note: this is a polytype of Hiortdahlite I Mineralogy and Petrology, 1987, 37, 25-35 |
| 9009827 | CIF | Al Ca Cu O9 Si2 | C 1 2/m 1 | 12.926; 11.496; 4.696 90; 100.81; 90 | 685.43 | Groat, L. A.; Hawthorne, F. C. Refinement of the structure of papagoite, CaCuAlSi2O6(OH)3 Note: U(1,1)(O3) changed from .0068 to match reported Uiso Mineralogy and Petrology, 1987, 37, 89-96 |
| 9009828 | CIF | Al Fe0.5 H13.5 O9 P | P -1 | 5.19; 10.419; 7.033 105; 111.31; 70.87 | 330.494 | Hawthorne, F. C. Sigloite: The oxidation mechanism in [M2(PO4)2(OH)2(H21O)2] structures Mineralogy and Petrology, 1988, 38, 201-211 |
| 9009829 | CIF | Cl Cu7 K O24 S5 Te | P 4/n c c :2 | 9.833; 9.833; 20.591 90; 90; 90 | 1990.9 | Pertlik, F.; Zemann, J. The crystal structure of nabokoite, Cu7TeO4(SO4)5*KCl: The first example of a Te(IV)O4 pyramid with exactly tetragonal symmetry Mineralogy and Petrology, 1988, 38, 291-298 |
| 9009830 | CIF | Cu O4 S | P n m a | 8.409; 6.709; 4.833 90; 90; 90 | 272.658 | Wildner, M.; Giester, G. Crystal structure refinements of synthetic chalcocyanite (CuSO4) and zincosite (ZnSO4) Mineralogy and Petrology, 1988, 39, 201-209 |
| 9009831 | CIF | O4 S Zn | P n m a | 8.604; 6.746; 4.774 90; 90; 90 | 277.095 | Wildner, M.; Giester, G. Crystal structure refinements of synthetic chalcocyanite (CuSO4) and zincosite (ZnSO4) Mineralogy and Petrology, 1988, 39, 201-209 |
| 9009832 | CIF | C0.24 H6.76 Mg12 O29.76 P5.76 | P 3 1 m | 11.203; 11.203; 4.977 90; 90; 120 | 540.962 | Romming, C.; Raade, G. The crystal structure of natural and synthetic holtedahlite Mineralogy and Petrology, 1989, 40, 91-100 |
| 9009833 | CIF | H7 Mg12 O30 P6 | P 3 1 m | 11.186; 11.186; 4.977 90; 90; 120 | 539.322 | Romming, C.; Raade, G. The crystal structure of natural and synthetic holtedahlite Mineralogy and Petrology, 1989, 40, 91-100 |
| 9009834 | CIF | Cu3 H3 O7 P | P b c a | 10.854; 14.053; 7.086 90; 90; 90 | 1080.84 | Eby, R. K.; Hawthorne, F. C. Cornetite: modulated densely-packed Cu2+ oxysalt Mineralogy and Petrology, 1989, 40, 127-136 |
| 9009835 | CIF | Mn O5 Te2 | P 42/n b c :2 | 8.761; 8.761; 12.99 90; 90; 90 | 997.049 | Miletich, R. Copper-substituted manganese-denningites, Mn(Mn1-xCux)(Te2O5)2(0<=x<=1): synthesis and crystal chemistry Sample: x = 0.0 Mineralogy and Petrology, 1993, 48, 129-145 |
| 9009836 | CIF | Cu0.33 Mn1.67 O10 Te4 | P 42/n b c :2 | 8.747; 8.747; 12.902 90; 90; 90 | 987.132 | Miletich, R. Copper-substituted manganese-denningites, Mn(Mn1-xCux)(Te2O5)2(0<=x<=1): synthesis and crystal chemistry Sample: x = 0.33 Mineralogy and Petrology, 1993, 48, 129-145 |
| 9009837 | CIF | Cu0.48 Mn1.52 O10 Te4 | P 42/n b c :2 | 8.741; 8.741; 12.8684 90; 90; 90 | 983.211 | Miletich, R. Copper-substituted manganese-denningites, Mn(Mn1-xCux)(Te2O5)2(0<=x<=1): synthesis and crystal chemistry Sample: x = 0.48 Mineralogy and Petrology, 1993, 48, 129-145 |
| 9009838 | CIF | Cu0.8 Mn1.2 O10 Te4 | P 42/n b c :2 | 8.729; 8.729; 12.82 90; 90; 90 | 976.826 | Miletich, R. Copper-substituted manganese-denningites, Mn(Mn1-xCux)(Te2O5)2(0<=x<=1): synthesis and crystal chemistry Sample: x = 0.80 Mineralogy and Petrology, 1993, 48, 129-145 |
| 9009839 | CIF | Cu0.99 Mn1.01 O10 Te4 | P 42/n b c :2 | 8.723; 8.723; 12.777 90; 90; 90 | 972.211 | Miletich, R. Copper-substituted manganese-denningites, Mn(Mn1-xCux)(Te2O5)2(0<=x<=1): synthesis and crystal chemistry Sample: x = 0.99 Mineralogy and Petrology, 1993, 48, 129-145 |
| 9009840 | CIF | Al9 Ca3 H36 K O51 Si9 Sr | P 63/m m c | 13.224; 13.224; 15.988 90; 90; 120 | 2421.31 | Ruedinger B; Tillmanns E; Hentschel G Bellbergite - a new mineral with the zeolite structure type EAB Mineralogy and Petrology, 1993, 48, 147-152 |
| 9009841 | CIF | As3 Ca0.41 Cu0.39 Fe0.55 Mg2.45 Na0.76 O12 | C 1 2/c 1 | 11.882; 12.76; 6.647 90; 112.81; 90 | 928.967 | Auernhammer, M.; Effenberger, H.; Hentschel, G.; Reinecke, T.; Tillmanns, E. Nickenichite, a new arsenate from the Eifel, Germany Mineralogy and Petrology, 1993, 48, 153-166 |
| 9009842 | CIF | Ca3 H24 O22 S3 | R -3 c :H | 11.35; 11.35; 28.321 90; 90; 120 | 3159.59 | Weidenthaler, C.; Tillmanns, E.; Hentschel, G. Orschallite, Ca3(SO3)2SO4*12H2O, a new calcium-sulfite-sulfate-hydrate mineral Locality: Hannebacher Ley, Hannebach, Eifel, Germany Mineralogy and Petrology, 1993, 48, 167-177 |
| 9009843 | CIF | As2 Cl4 Fe H4 O8 Pb4 | P -1 | 6.548; 10.243; 5.587 96.2; 89.6; 97.7 | 369.165 | Pertlik, F.; Schnorrer, G. A re-appraisal of the chemical formula of nealite, Pb4Fe(AsO3)2Cl4*2H2O, on the basis of a crystal structure determination Mineralogy and Petrology, 1993, 48, 193-200 |
| 9009844 | CIF | Bi0.01 Cs0.31 F0.5 H0.5 Na0.31 Nb0.12 O6.19 Pb0.02 Sb0.57 Ta1.88 | F d -3 m :2 | 10.515; 10.515; 10.515 90; 90; 90 | 1162.59 | Ercit, T. S.; Cerny, P.; Hawthorne, F. C. Cesstibtantite - a geologic introduction to the inverse pyrochlores Sample: KO-1 Mineralogy and Petrology, 1993, 48, 235-255 |
| 9009845 | CIF | Bi0.02 Ca0.06 Cs0.22 F0.385 H0.385 K0.01 Na0.45 Nb0.05 O6.165 Pb0.14 Sb0.39 Ta1.95 | F d -3 m :2 | 10.496; 10.496; 10.496 90; 90; 90 | 1156.3 | Ercit, T. S.; Cerny, P.; Hawthorne, F. C. Cesstibtantite - a geologic introduction to the inverse pyrochlores Loclity: Tanco pegmatite, Manitoba, Canada Sample: SMP 6 Mineralogy and Petrology, 1993, 48, 235-255 |
| 9009846 | CIF | Ca5 O12 S Si2 | P n m a | 6.863; 15.387; 10.181 90; 90; 90 | 1075.12 | Irran, E.; Tillmanns, E.; Hentschel, G. Ternesite, Ca5(SiO4)2SO4, a new mineral from the Ettringer Bellerberg/Eifel, Germany Locality: Ettringer Bellerberg volcano, Eifel, Germany Mineralogy and Petrology, 1997, 60, 121-132 |
| 9009847 | CIF | Bi Fe H O7 P Pb | C 1 2/m 1 | 12.278; 3.815; 6.899 90; 111.14; 90 | 301.406 | Krause, W.; Bernhardt, H. J.; McCammon, C.; Effenberger, H. Brendelite, (Bi,Pb)2Fe3+,2+O2(OH)(PO4), a new mineral from Schneeberg, Germany: description and crystal structure Mineralogy and Petrology, 1998, 63, 263-277 |
| 9009848 | CIF | Ba0.84 Fe9.363 K0.05 Mg0.305 Na0.06 O19 Sr0.05 Ti2.328 | P 63/m m c | 5.909; 5.909; 23.369 90; 90; 120 | 706.641 | Lengauer, C. L.; Tillmanns, E.; Hentschel, G. Batiferrite, Ba[Ti2Fe10]O19, a new ferrimagnetic magnetoplumbite-type mineral from the Quaternary volcanic rocks of the western Eifel area, Germany Note: z-coordinate of A-site altered because it was obviously a typo Locality: Quaternary volcanic rocks of the western Eifel area, Germany Mineralogy and Petrology, 2001, 71, 1-19 |
| 9009849 | CIF | As Cu H O9 Pb2 S | P 1 21/m 1 | 7.804; 5.89; 8.964 90; 112.29; 90 | 381.246 | Zubkova, N. V.; Pushcharovsky, D. Y.; Giester, G.; Tillmanns, E.; Pekov, I. V.; Kleimenov, D. A. The crystal structure of arsentsumebite, Pb2Cu[(As,S)O4]2(OH) Locality: oxidation zone of the Berezovskoye gold deposit, Middle Urals, Russia Mineralogy and Petrology, 2002, 75, 79-88 |
| 9009850 | CIF | Bi2 O3 | F m -3 m | 5.6549; 5.6549; 5.6549 90; 90; 90 | 180.832 | Yashima, M.; Ishimura, D. Crystal structure and disorder of the fast oxide-ion conductor cubic Bi2O3 Note: sample at T = 778 deg C Note: this is called gamma-Bi2O3 Chemical Physics Letters, 2003, 378, 395-399 |
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