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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9014294 | CIF | Ca4 F3 Na2 O15 Si4 Y 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 Mineralogy and Petrology, 2010, 37, 25-35 |
| 9014297 | CIF | Mg2 O4 Si | P n m a | 10.20141; 5.98348; 4.75534 90; 90; 90 | 290.266 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo Journal of Applied Crystallography, 1999, 32, 51-59 |
| 9014298 | CIF | Ca0.498 Eu0.299 F3 Na0.558 Y0.198 | P 63/m | 6.0403; 6.0403; 3.5899 90; 90; 120 | 113.431 | Frank-Kamenetskaya, O. V.; Fundamenskii, V. S.; Tsytsenko, A. K.; Frank-Kamenetskii, V. A. Crystal structure of gagarinite from precision X-ray data: Structural changes in the NaCaTRF6-Na1.5TR1.5F6 series Crystallography Reports, 1994, 39, 923-928 |
| 9014301 | CIF | H0.5 K1.5 Mg2 O7 Si2 | P 63/m c m | 5.0646; 5.0646; 13.2379 90; 90; 120 | 294.063 | Welch, M. D.; Konzett, J.; Bindi, L.; Kohn, S. C.; Frost, D. J. New structural features of the high-pressure synthetic sheet-disilicate Phase-X, K(2-x)Mg2Si2O7Hx American Mineralogist, 2012, 97, 1849-1857 |
| 9014304 | CIF | Cu3 H6 O11 V2 | C 1 2/m 1 | 10.657; 5.887; 7.228 90; 95.035; 90 | 451.7 | Yoshida, H.; Yamaura, J.; Isobe, M.; Nilsen, G. J.; Hiroi, Z. Orbital Switching in a Frustrated Magnet Nature Communications, 2012, 3, 860-865 |
| 9014305 | CIF | Ag As0.929 Hg S3 Sb0.071 | A 1 a 1 | 7.756; 11.334; 6.665 90; 115.233; 90 | 529.992 | Pervukhina, N. V.; Borisov, S. V.; Magarill, S. A.; Vasil'ev, V. I.; Kuratieva, N. V. Redetermination and crystallographic analysis of the structure of Sb-containing laffittite AgHg(As,Sb)S3 from Chauvai (Kyrgyzstan) Journal of Structural Chemistry, 2010, 51, 683-688 |
| 9014306 | CIF | Au Sb2 | P a -3 | 6.6583; 6.6583; 6.6583 90; 90; 90 | 295.182 | Furuseth, S.; Selte, K.; Kjekshus, A. Redetermined crystal structures of PdAs2, PdSb2, PtP2, PtAs2, PtSb2, alpha-PtBi2, and AuSb2 Acta Chemica Scandinavica, 1965, 19, 735-741 |
| 9014308 | CIF | Al6 Ca8.5 Na O18 | P b c a | 10.875; 10.859; 15.105 90; 90; 90 | 1783.77 | Nishi, F.; Takeuchi, Y. The Al6O18 rings of tetrahedra in the structure of Ca8.5NaAl6O18 Acta Crystallographica, Section B, 1975, 31, 1169-1173 |
| 9014309 | CIF | Fe1.001 Nb0.13 O6 Ta1.869 | P 42/m n m | 4.7531; 4.7531; 9.2873 90; 90; 90 | 209.818 | Zema, M.; Tarantino, S. C.; Giorgiani, A. Structural changes induced by cation ordering in ferrotapiolite Note: Crystal Kim9_q0, untreated Mineralogical Magazine, 2006, 70, 319-328 |
| 9014312 | CIF | C H2.5 Cl1.5 O14.5 Pb6 Te2 | C 1 2/c 1 | 21.305; 11.059; 7.564 90; 101.112; 90 | 1748.76 | Kampf, A. R.; Housley, R. M.; Marty, J. Lead-tellurium oxysalts from Otto Mountain near Baker, California: III. Thorneite, Pb6(Te6+2O10)(CO3)Cl2(H2O), the first mineral with edge-sharing octahedral tellurate dimers American Mineralogist, 2010, 95, 1548-1553 |
| 9014315 | CIF | Ni Ti | P -3 | 7.341; 7.341; 5.26996 90; 90; 120 | 245.951 | Sitepu, H. Texture and structural refinement using neutron diffraction data from molybdite (MoO3) and calcite (CaCO3) powders and a Ni-rich Ni50.7Ti49.30 alloy Note: Aged Powder Diffraction, 2009, 24, 315-326 |
| 9014317 | CIF | Al7.296 B3 Ca0.682 F0.669 Fe0.045 H3.331 Li1.626 Mn0.027 Na0.248 O30.331 Pb0.009 Si6 Ti0.003 | R 3 m :H | 15.8343; 15.8343; 7.1012 90; 90; 120 | 1541.91 | 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: L19, ordered model The Canadian Mineralogist, 2011, 49, 63-88 |
| 9014318 | CIF | Ca0.82 F1.25 Mn0.79 Na1.18 O7.75 Si2 Ti0.477 Zr0.733 | P 1 21/a 1 | 10.8475; 9.9364; 7.1488 90; 108.392; 90 | 731.175 | Biagioni, C.; Merlino, S.; Parodi, G. C.; Perchiazzi, N. Crystal chemistry of minerals of the wohlerite group from the Los Archipelago, Guinea The Canadian Mineralogist, 2012, 50, 593-609 |
| 9014319 | CIF | Ca2 Fe2 O5 | P n m a | 5.3422; 14.5385; 5.5277 90; 90; 90 | 429.323 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 6.326 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
| 9014320 | CIF | Mn2 O4 Si | P n m a | 10.60016; 6.25753; 4.90338 90; 90; 90 | 325.245 | Yamazaki, S.; Toraya, H. Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1 Journal of Applied Crystallography, 1999, 32, 51-59 |
| 9014322 | CIF | C6 H34.56 Ca4 F2 Mg O39.28 U2 | P -1 | 13.569; 13.419; 11.622 115.82; 107.61; 92.84 | 1774.63 | Mereiter, K. The crystal structure of albrechtschraufite, MgCa4F2[UO2(CO3)3]2*17-18H2O Mineralogy and Petrology, 2013, pre-print |
| 9014323 | CIF | Fe2 K Li Na2 O24 Si8 Ti2 | C 1 2/c 1 | 16.46; 12.5; 10.01 90; 115.43; 90 | 1860.01 | Cannillo, E.; Mazzi, F.; Rossi, G. The crystal structure of neptunite Acta Crystallographica, 1966, 21, 200-208 |
| 9014324 | CIF | Al0.875 Cr0.125 Nb O4 | C 1 2/m 1 | 12.1724; 3.755; 6.4957 90; 107.67; 90 | 282.894 | Ardit, M.; Dondi, M.; Cruciani, G. Structural stability, cation ordering, and local relaxation along the AlNbO4-Al0.5Cr0.5NbO4 join Note: Sample label: N12 American Mineralogist, 2012, 97, 910-917 |
| 9014326 | CIF | Cu1.48 Fe0.54 K0.737 S2 | I 4/m m m | 3.846; 3.846; 13.308 90; 90; 90 | 196.848 | Pekov, I. V.; Zubkova, N. V.; Lisitsyn, D. V.; Pushcharovsky, D. Y. Crystal chemistry of murunskite Doklady Earth Sciences, 2009, 424, 139-141 |
| 9014327 | CIF | Ge O2 | P 32 2 1 | 4.831; 4.831; 5.568 90; 90; 120 | 112.539 | Yamanaka, T.; Ogata, K. Structure refinement of GeO2 polymorphs at high pressures and temperatures by energy-dispersive spectra of powder diffraction Note: P = 4.58 GPa T = 293 K Note: quartz structure Journal of Applied Crystallography, 1991, 24, 111-118 |
| 9014330 | CIF | Hg I2 | P 42/n m c :2 | 4.365; 4.365; 12.389 90; 90; 90 | 236.05 | Schwarzenbach, D.; Birkedal, H.; Hostettler, M.; Fischer, P. Neutron diffraction investigation of the temperature dependence of crystal structure and thermal motions of red HgI2 Note: T = 200 K, powder neutron data Acta Crystallographica, Section B, 2007, 63, 828-835 |
| 9014331 | CIF | Ca2.5 O9 Si3 | I 1 2/m 1 | 5.593; 3.645; 22.45599 90; 96.97; 90 | 454.415 | Hoffmann, C.; Armbruster, T. Clinotobermorite, Ca5(Si3O8(OH))2*4(H2O) - Ca5(Si6O17)*5(H2O), a natural C-S-H(I) type cement mineral: determination of the substructure _cod_database_code 1000046 Zeitschrift fur Kristallographie, 1997, 212, 863-873 |
| 9014333 | CIF | Al3 Bi0.49 Ca0.23 H6 O14 P1.8 Si0.2 Sr0.28 | R -3 m :H | 7.0059; 7.0059; 16.3431 90; 90; 120 | 694.693 | Mills, S. J.; Kampf, A. R.; Raudsepp, M.; Birch, W. D. The crystal structure of waylandite from Wheal Remfry, Cornwall, United Kingdom Mineralogy and Petrology, 2010, 100, 249-253 |
| 9014334 | CIF | Al1.61 Fe0.39 Mg O4 | F d -3 m :2 | 8.1472; 8.1472; 8.1472 90; 90; 90 | 540.786 | 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 = 9 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9014336 | CIF | Al0.761 Fe3.239 H36 O42 S6 | P -3 1 c | 10.937; 10.937; 17.0813 90; 90; 120 | 1769.49 | Demartin, F.; Castellano, C.; Gramaccioli, C. M.; Campostrini, I. Aluminum-for-iron substitution, hydrogen bonding, and a novel structure-type in coquimbite-like minerals The Canadian Mineralogist, 2010, 48, 323-333 |
| 9014338 | CIF | Ba0.5 Cu O10 Si4 Sr0.5 | P 4/n c c :2 | 7.39425; 7.39425; 15.8621 90; 90; 90 | 867.259 | Knight, K. S.; Henderson, C. M. B. Structural basis for the anomalous low-temperature thermal expansion behavior of the gillespite-structured phase Ba0.5Sr0.5CuSi4O10 Sample: T = 300 K European Journal of Mineralogy, 2007, 19, 189-200 |
| 9014339 | CIF | Al2 Cu0.69 Mg0.31 O4 | F d -3 m :2 | 8.0857; 8.0857; 8.0857 90; 90; 90 | 528.631 | Fregola, R. A.; Bosi, F.; Skogby, H.; Halenius, U. Cation ordering over short-range and long-range scales in the MgAl2O4-CuAl2O4 series Sample: CuAl90dw American Mineralogist, 2012, 97, 1821-1827 |
| 9014340 | CIF | C3 K4 O11 U | C 1 2/c 1 | 10.238; 9.193; 12.211 90; 95.108; 90 | 1144.71 | Skala, R.; Ondrus, P.; Veselovsky, F.; Cisarova, I.; Hlousek, J. Agricolaite, a new mineral of uranium from Jachymov, Czech Republic Mineralogy and Petrology, 2011, 103, 169-175 |
| 9014341 | CIF | Ca H7 O15 Si4 V | P c m n | 9.794; 13.67; 9.643 90; 90; 90 | 1291.04 | Ishida, N.; Kimata, M.; Nishida, N.; Hatta, T.; Shimizu, M.; Akasaka, T. Polymorphic relation between cavanite and pentagonite: genetic implications of oxonium ion in cavansite Journal of Mineralogical and Petrological Sciences, 2009, 104, 241-252 |
| 9014342 | CIF | O4 Se Sr | P 1 21/n 1 | 7.101; 7.34; 6.874 90; 103.48; 90 | 348.412 | Effenberger, H.; Pertlik, F. Four monazite type structures: comparison of SrCrO4, SrSeO4, PbCrO4 (crocoite), and PbSeO4 Zeitschrift für Kristallographie, 1986, 176, 75-83 |
| 9014344 | CIF | C Ca O3 | R -3 c :H | 4.9761; 4.9761; 17.4163 90; 90; 120 | 373.478 | Antao, S. M.; Hassan, I. Temperature dependence of the structural parameters in the transformation of aragonite to calcite, as determined from in situ synchrotron powder X-ray-diffraction data Note: T = 644 C Note: P = 101 kPa The Canadian Mineralogist, 2010, 48, 1225-1236 |
| 9014345 | CIF | H10.3 K2.98 Na1.22 Nb2.2 O31.15 Si8 Ti1.8 | C 1 m 1 | 14.692; 14.164; 7.859 90; 117.87; 90 | 1445.74 | Rastsvetaeva, R. K.; Tamazyan, R. A.; Pushcharovskii D Yu; Nadezhina, T. N.; Voloshin, A. V. K-nenadkevichite, a new representative of the nenadkevichite-labuntsovite series Crystallography Reports, 1994, 39, 908-914 |
| 9014346 | CIF | Be O | P 63 m c | 2.6983; 2.6983; 4.3776 90; 90; 120 | 27.602 | Hazen, R. M.; Finger, L. W. High-pressure and high-temperature crystal chemistry of beryllium oxide Note: Crystal no. 1 in cell Journal of Applied Physics, 1986, 59, 3728-3733 |
| 9014348 | CIF | Na Nb O3 | P b c m | 5.5007; 5.5621; 15.5373 90; 90; 90 | 475.371 | Mishchuk, D. O.; V'yunov, O. I.; Ovchar, O. V.; Belous, A. G. Structural and dielectric properties of solid solutions of sodium niobate in lanthanum and neodymium niobates Note: La2/3-x Na3x Nb2O6 synthesized at 1350 deg C Note: x = .66, Na2Nb2O6 Inorganic Materials, 2004, 40, 1324-1330 |
| 9014351 | CIF | Al0.55 Ca2 Fe1.45 O5 | I 2 m b | 5.3394; 14.4853; 5.5584 90; 90; 90 | 429.902 | Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F. The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.55 Note: P = 3.21 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
| 9014352 | CIF | Ca Na2 O8 S2 | C 1 2/c 1 | 10.158; 8.333; 8.551 90; 112.333; 90 | 669.521 | Cocco, G.; Corazza, E.; Sabelli, C. The crystal structure of glauberite, CaNa2(SO4)2 Zeitschrift fur Kristallographie, 1965, 122, 175-184 |
| 9014354 | CIF | Fe0.183 Li0.86 Mn0.8 O4 P | P b n m | 4.734; 10.423; 6.094 90; 90; 90 | 300.693 | Hatert, F.; Ottolini, L.; Wouters, J.; Fontan, F. A structural study of the lithiophilite-sicklerite series Sample 2, light yellow The Canadian Mineralogist, 2012, 50, 843-854 |
| 9014355 | CIF | C Ca O3 | P m c n | 4.9653; 8.0088; 5.7847 90; 90; 90 | 230.035 | Antao, S. M.; Hassan, I. Temperature dependence of the structural parameters in the transformation of aragonite to calcite, as determined from in situ synchrotron powder X-ray-diffraction data Note: T = 235 C Note: P = 101 kPa The Canadian Mineralogist, 2010, 48, 1225-1236 |
| 9014356 | CIF | As2.874 Ca2.01 Mg1.758 Mn0.242 Na0.99 O12 V0.126 | I a -3 d | 12.3404; 12.3404; 12.3404 90; 90; 90 | 1879.26 | Nagashima, M.; Armbruster, T. Palenzonaite, berzeliite, and manganberzeliite:(As5+,V5+,Si4+)O4 tetrahedra in garnet structures Mineralogical Magazine, 2012, 76, 1081-1097 |
| 9014357 | CIF | As0.08 Ca0.15 Ce0.15 Nd0.15 O4 Th0.15 V0.92 Y0.4 | I 41/a m d :2 | 7.2591; 7.2591; 6.4255 90; 90; 90 | 338.589 | Cadoni, M.; Ciriotti, M. E.; Ferraris, G. Wakefieldite-(Y) from Montaldo di Mondovi (Italy): new data and crystal structure Rendiconti Lincei Scienze Fisiche e Naturali, 2011, 22, 307-314 |
| 9014358 | CIF | Al7.371 B1.967 Fe0.605 Mg0.24 O18.484 Si1.82 | P -1 | 7.9696; 8.1559; 11.3607 110.364; 110.881; 84.67 | 646.409 | Grew, E. S.; Armbruster, T.; Lazic, P.; Yates, M. G.; Medenbach, O.; Huijsmans, J. P. P. Werdingite from a pegmatite at Almgjotheii, Rogaland, Norway: The role of iron in a borosilicate with a mullite-type structure European Journal of Mineralogy, 2011, 23, 577-589 |
| 9014359 | CIF | Al2 Ca3 O6 | P m -3 m | 7.624; 7.624; 7.624 90; 90; 90 | 443.148 | Steele, F. A.; Davey, W. P. The crystal structure of tricalcium aluminate Journal of the American Chemical Society, 1929, 51, 2283-2293 |
| 9014362 | CIF | Ca3 O5 Si | P -1 | 11.67; 14.24; 13.72 105.5; 94.33; 90 | 2190.32 | Golovastikov, N.; Matveeva, R.; Belov, N. Crystal structure of tricalcium silicate, 3CaO.SiO2 = C3S Kristallografiya, 1975, 20, 721-729 |
| 9014363 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.4848; 11.4848; 11.4848 90; 90; 90 | 1514.85 | 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 = 572.9 K American Mineralogist, 2011, 96, 1593-1605 |
| 9014364 | CIF | Ca3 O8 V2 | C 1 2/m 1 | 9.6715; 5.43276; 7.0713 90; 116.949; 90 | 331.201 | Grzechnik, A. Crystal structure of Ca3(VO4)2 synthesized at 11 GPa and 1373 K Solid State Sciences, 2002, 4, 523-524 |
| 9014365 | CIF | Fe1.001 Nb0.13 O6 Ta1.869 | P 42/m n m | 4.7571; 4.7571; 9.2189 90; 90; 90 | 208.624 | Zema, M.; Tarantino, S. C.; Giorgiani, A. Structural changes induced by cation ordering in ferrotapiolite Note: Crystal Kim23_q2, treated at 750 C for 190 min Mineralogical Magazine, 2006, 70, 319-328 |
| 9014367 | CIF | C Fe O3 | R -3 c :H | 4.3462; 4.3462; 12.519 90; 90; 120 | 204.795 | 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 P27-2, P = 55.0 GPa Physical Review B, 2010, 82, 064110-064118 |
| 9014368 | CIF | Al8.922 B6.15 Ca0.01 F0.26 Fe1.338 H8.22 K0.01 Li0.42 Mn0.798 Na0.56 O42.74 Si5.568 Ti0.018 Zn0.06 | R 3 m :H | 15.883; 15.883; 7.1093 90; 90; 120 | 1553.18 | Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E. Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample MAG European Journal of Mineralogy, 2012, 24, 695-715 |
| 9014369 | CIF | Na11 O14 Si4 Ti4 | P 42/m b c | 10.6772; 10.6772; 11.885 90; 90; 90 | 1354.92 | Thorogood, G. J.; Kennedy, B. J.; Griffith, C. S.; Elcombe, M. E.; Avdeev, M.; Hanna, J. V.; Thorogood, S. K.; Luca, V. Structure and phase transformations in the titanosilicate, sitinakite. The importance of water Note: T = 573 K dehydrated sample Chemistry of Materials, 2010, 22, 4222-4231 |
| 9014370 | CIF | H2 Mg3 O10 S2 | I 41/a m d :2 | 5.254; 5.254; 12.971 90; 90; 90 | 358.058 | Yamnova, N. A.; Pushcharovskii, D. Y.; Apollonov, V. N. Crystalline structure of a new natural Mg-sulfate Mg3[SO4]2(OH)2 Vestnik Moskovskogo Universiteta Geologiya, 1989, 44, 76-78 |
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