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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9014206 | CIF | Ba0.5 Cu O10 Si4 Sr0.5 | P 4/n c c :2 | 7.39533; 7.39533; 15.8482 90; 90; 90 | 866.752 | 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 = 100 K European Journal of Mineralogy, 2007, 19, 189-200 |
| 9014208 | CIF | Al8.517 B3.54 Be0.03 Ca0.241 Fe0.189 H3.32 Li0.342 Mg0.009 Mn0.006 Na0.48 O31 Si5.13 Ti0.009 | R 3 m :H | 15.7713; 15.7713; 7.076 90; 90; 120 | 1524.24 | Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F. Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T2 American Mineralogist, 2004, 89, 447-454 |
| 9014209 | CIF | Cu4 H6 Mo2 O16 U | B 1 1 2/m | 19.8392; 5.5108; 6.1009 90; 90; 104.477 | 645.832 | Tali, R.; Tabachenko, V. V.; Kovba, L. M. Crystal structure of Cu4UO2(MoO4)2(OH)6 Russian Journal of Inorganic Chemistry, 1993, 38, 1350-1352 |
| 9014210 | CIF | Al2.32 As3 Ba0.51 Fe1.68 H4 O18 | P -4 3 m | 7.85; 7.85; 7.85 90; 90; 90 | 483.737 | Mills, S. J.; Rumsey, M. S.; Favreau, G.; Spratt, J.; Raudsepp, M.; Dini, M. Bariopharmacoalumite, a new mineral species from Cap Garonne, France and Mina Grande, Chile Mineralogical Magazine, 2011, 75, 135-144 |
| 9014211 | CIF | Cd Cu H3 N O6 | P 1 21/m 1 | 5.846; 6.613; 6.697 90; 99.44; 90 | 255.397 | Effenberger, H. CdCu(OH)3(NO3), a new layer compound Zeitschrift fur Kristallographie, 2002, 19, 85-85 |
| 9014212 | CIF | H3 K0.62 Na0.38 O10 Si2.5 U | C m m m | 7.092; 17.888; 7.113 90; 90; 90 | 902.367 | Baturin, S. V. Crystal-structure of weeksite Doklady Akademii Nauk SSSR, 1985, 282, 1132-1136 |
| 9014215 | CIF | Al8.697 B3.618 Be0.036 Ca0.29 Fe0.084 H3.41 K0.002 Li0.366 Mg0.006 Mn0.009 Na0.408 O31 Si4.992 Ti0.006 | R 3 m :H | 15.7537; 15.7537; 7.0707 90; 90; 120 | 1519.7 | Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F. Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T1 American Mineralogist, 2004, 89, 447-454 |
| 9014216 | CIF | C Ca O3 | R -3 c :H | 4.9759; 4.9759; 17.4316 90; 90; 120 | 373.776 | 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 = 662 C Note: P = 101 kPa The Canadian Mineralogist, 2010, 48, 1225-1236 |
| 9014217 | CIF | Al1.37 Ba0.05 F0.16 Fe0.776 H1.34 K0.85 Mg2.224 Na0.07 O11.84 Si2.63 | C 1 2/m 1 | 5.3379; 9.2414; 10.2311 90; 100.023; 90 | 496.994 | Zema, M.; Ventruti, G.; Lacalamita, M.; Scordari, F. Kinetics of Fe-oxidation/deprotonation process in Fe-rich phlogopite under isothermal conditions Sample: SA1_9 American Mineralogist, 2010, 95, 1458-1466 |
| 9014218 | CIF | As2 Pd | P a -3 | 5.9855; 5.9855; 5.9855 90; 90; 90 | 214.438 | 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 |
| 9014219 | CIF | As3 Ba0.5 Fe4 H16.32 O22.16 | P -4 2 m | 7.947; 7.947; 8.049 90; 90; 90 | 508.333 | Hager, S. L.; Leverett, P.; Williams, P. A.; Mills, S. J.; Hibbs, D. E.; Raudsepp, M.; Kampf, A. R.; Birch, W. D. The single-crystal X-ray structures of bariopharmacosiderite-C, bariopharmacosiderite-Q and natropharmacosiderite Note: sample Bariopharmacosiderite-Q The Canadian Mineralogist, 2010, 48, 1477-1485 |
| 9014220 | CIF | B11 Ca0.62 H7 O22 Sr1.38 | C 1 c 1 | 6.607; 11.7125; 20.6848 90; 91.998; 90 | 1599.71 | Grice, J. D.; Pring, A. Veatchite: structural relationships of the three polytypes Note: moderate-T, high-P polytype veatchite-2M American Mineralogist, 2012, 97, 489-495 |
| 9014221 | CIF | Al7.203 B3 Ca0.63 F0.691 Fe0.123 H3.309 Li1.524 Mg0.069 Mn0.069 Na0.338 O30.309 Pb0.007 Si6 Ti0.012 | R 3 m :H | 15.8404; 15.8404; 7.1039 90; 90; 120 | 1543.69 | 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: L28, ordered model The Canadian Mineralogist, 2011, 49, 63-88 |
| 9014222 | CIF | Co F6 Np O3 | C 1 2 1 | 12.119; 6.908; 7.928 90; 92.84; 90 | 662.902 | Abazli, H.; Cousson, A.; Jove, J.; Pages, M.; Gasperin, M. Les composes Co Np F6 (H2 O)3 et Co U F6 (H2 O)3. Etude structurale, mesur des susceptibilites magnetiques et resonance Moessbauer (237 Np) _cod_database_code 1001329 Journal of the Less-Common Metals, 1984, 96, 23-33 |
| 9014223 | CIF | O4 Pb Se | P 1 21/n 1 | 7.154; 7.407; 6.954 90; 103.14; 90 | 358.842 | Effenberger, H.; Pertlik, F. Four monazite type structures: comparison of SrCrO4, SrSeO4, PbCrO4 (crocoite), and PbSeO4 Zeitschrift für Kristallographie, 1986, 176, 75-83 |
| 9014224 | CIF | B Ce O5 Si | P 31 | 6.85; 6.85; 6.7 90; 90; 120 | 272.262 | Voronkov, A. A.; Pyatenko, Y. A. X-ray diffraction study of the atomic structure of stillwellite CeBO[SiO4] Soviet Physics Crystallography, 1967, 12, 214-220 |
| 9014225 | CIF | Fe Nb0.2 O6 Ta1.8 | P 42/m n m | 4.7515; 4.7515; 9.254 90; 90; 90 | 208.925 | von Heidenstam, O. Neutron and X-ray diffraction studies on tapiolite and some synthetic substances of trirutile structure Note: Crystal A and B combined Arkiv for Kemi, 1968, 28, 375-387 |
| 9014226 | CIF | Al1.461 Fe0.538 Mg1.001 O4 | F d -3 m :2 | 8.171; 8.171; 8.171 90; 90; 90 | 545.539 | 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 = 3069 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9014227 | CIF | B11 Ca0.087 H7 O22 Sr1.913 | P -1 | 6.6378; 6.7387; 20.982 87.86; 82.696; 60.476 | 809.684 | Grice, J. D.; Pring, A. Veatchite: structural relationships of the three polytypes Note: low-T, low-P polytype veatchite-1A American Mineralogist, 2012, 97, 489-495 |
| 9014228 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8325; 7.6041; 9.63 90; 90.184; 90 | 353.87 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study Note: T = 220 K American Mineralogist, 2010, 95, 1413-1421 |
| 9014229 | CIF | Al1.36 Fe0.766 H1.597 K Mg2.234 O12 Si2.64 | C 1 2/m 1 | 5.3435; 9.253; 10.2458 90; 100.006; 90 | 498.882 | Zema, M.; Ventruti, G.; Lacalamita, M.; Scordari, F. Kinetics of Fe-oxidation/deprotonation process in Fe-rich phlogopite under isothermal conditions Sample: SA1_15n American Mineralogist, 2010, 95, 1458-1466 |
| 9014230 | CIF | Ba O3 Ti | R 3 m :R | 4.0036; 4.0036; 4.0036 89.84; 89.84; 89.84 | 64.172 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 20 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 9014231 | CIF | Fe | F m -3 m | 3.539; 3.539; 3.539 90; 90; 90 | 44.324 | Nishihara, Y.; Nakajima, Y.; Akashi, A.; Tsujino, N.; Takahashi, E.; Funakoshi, K.; Higo, Y. Isothermal compression of face-centered cubic iron Note: gamma iron, Sample M605, P = 14.45 GPa, T = 1273 K American Mineralogist, 2012, 97, 1417-1420 |
| 9014233 | CIF | H6 Mg O6 Si | P 1 21 1 | 5.1131; 5.1898; 7.3303 90; 90.03; 90 | 194.517 | Wunder, B.; Jahn, S.; Koch-Muller M; Speziale, S. The 3.65 A phase, MgSi(OH)6: structural insights from DFT-calculations and T-dependent IR spectroscopy American Mineralogist, 2012, 97, 1043-1048 |
| 9014235 | CIF | Fe4 O5 | C m c m | 2.843; 9.7; 12.29 90; 90; 90 | 338.923 | Lavina, B.; Dera, P.; Kim, E.; Meng, Y.; Downs, R. T.; Weck, P. F.; Sutton, S. R.; Zhao, Y. Discovery of the recoverable high-pressure iron oxide Fe4O5 Note: P = 10 GPa Proceedings of the National Academy of Sciences, 2011, 108, 17281-17284 |
| 9014237 | CIF | C Fe O3 | R -3 c :H | 4.579; 4.579; 14.28 90; 90; 120 | 259.299 | 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 P8, P = 19.19 GPa Physical Review B, 2010, 82, 064110-064118 |
| 9014240 | CIF | Ca4 H2 O11 Si3 | A m a 2 | 20.5805; 10.324; 9.1053 90; 90; 90 | 1934.6 | Armbruster, T.; Lazic, B.; Galuskina, I. O.; Galuskin, E. V.; Gnos, E.; Marzec, K. M.; Gazeev, V. M. Trabzonite, Ca4[Si3O9(OH)]OH: crystal structure, revised formula, new occurrence and relation to killalaite Mineralogical Magazine, 2012, 76, 455-472 |
| 9014242 | CIF | Ca3.64 O67.52 Si24 | I m m a | 20.326; 23.883; 12.836 90; 90; 90 | 6231.18 | Arletti, R.; Quartieri, S.; Vezzalini, G. Elastic behavior of zeolite boggsite in silicon oil and aqueous medium: A case of high-pressure-induced over hydration, Sample: P = 0.0 GPa on release of pressure Note: assignment of site chemistry does not match chemical analysis American Mineralogist, 2010, 95, 1247-1256 |
| 9014243 | CIF | Fe4 O5 | C m c m | 2.87366; 9.694; 12.4116 90; 90; 90 | 345.753 | Woodland, A. B.; Frost, D. J.; Trots, D. M.; Klimm, K.; Mezouar, M. In situ observation of the breakdown of magnetite (Fe3O4) to Fe4O5 and hematite at high pressures and temperatures American Mineralogist, 2012, 97, 1808-1811 |
| 9014245 | CIF | Al5.636 As0.067 Bi0.06 Ca9.156 Cl0.064 Fe0.223 Mn0.864 O39 Si9 | P 4/n n c :2 | 15.5852; 15.5852; 11.7782 90; 90; 90 | 2860.91 | Groat, L. A.; Evans, R. J. Crystal chemistry of Bi- and Mn-bearing vesuvianite from Langban, Sweden Note: sample vesuvianite 2 American Mineralogist, 2012, 97, 1627-1634 |
| 9014246 | CIF | Al Ca2 F7 H2 O | C -1 | 9.4227; 6.967; 9.2671 90.974; 104.802; 90.026 | 588.085 | Kampf, A. R.; Colombo, F.; Gonzalez del Tanago, J. Carlhintzeite, Ca2AlF7*H2O, from the Gigante granitic pegmatite, Cordoba province, Argentina: description and crystal structure Mineralogical Magazine, 2010, 74, 623-632 |
| 9014250 | CIF | Pb10.159 S22 Sb7.841 | P 1 21/a 1 | 21.554; 23.454; 8.079 90; 100.76; 90 | 4012.35 | Kaden, R.; Wagner, G.; Bente, K. Crystal chemistry and electrical conductivity of boulangerite, dadsonite and iodine-substituted pillaite grown by chemical vapor transport The Canadian Mineralogist, 2012, 50, 219-233 |
| 9014252 | CIF | As2 O3 | P 1 21/n 1 | 4.546; 13.0012; 5.342 90; 94.329; 90 | 314.83 | Origlieri, M. J.; Downs, R. T.; Carducci, M. D.; Rosso, K. M.; Gibbs, G. V. Crystal structure and bonding in the new mineral AsSbO3 General Meeting of the International Mineralogical Association, 2006, 19, 142-142 |
| 9014254 | CIF | Al1.609 Fe0.389 Mg1.002 O4 | F d -3 m :2 | 8.1469; 8.1469; 8.1469 90; 90; 90 | 540.726 | 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 = 1 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9014255 | CIF | Al H24 K1.3 O20 S2 | P a -3 | 12.157; 12.157; 12.157 90; 90; 90 | 1796.71 | Larson, A. C.; Cromer, D. T. Refinement of the alum structures. III. X-ray study of the a alums, K, Rb and NH4Al(SO4)2*12H2O Acta Crystallographica, 1967, 22, 793-800 |
| 9014256 | CIF | H8 O8 S Zn | P 1 21/n 1 | 5.9144; 13.5665; 7.8924 90; 90.688; 90 | 633.222 | 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 |
| 9014258 | CIF | Al3 H13 O16 P2 | P -1 | 7.386; 7.716; 11.345 99.773; 91.141; 115.58 | 571.551 | Kampf, A. R.; Mills, S. J.; Rossman, G. R.; Steele, I. M.; Pluth, J. J.; Favreau, G. Afmite, Al3(OH)4(H2O)3(PO4)(PO3OH)*H2O,a new mineral from Fumade, Tarn, France: description and crystal structure T = 298 K European Journal of Mineralogy, 2011, 23, 269-277 |
| 9014261 | CIF | Cr2 O3 | R -3 c :H | 4.737; 4.737; 13.071 90; 90; 120 | 254.007 | Kantor, A.; Kantor, I.; Merlini, M.; Glazyrin, K.; Prescher, C.; Hanfland, M.; Dubrovinsky, L. High-pressure structural studies of eskolaite by means of single-crystal X-ray diffraction Note: P = 39.7 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 9014264 | CIF | Ge O2 | P 32 2 1 | 4.8546; 4.8546; 5.5943 90; 90; 120 | 114.178 | Yamanaka, T.; Ogata, K. Structure refinement of GeO2 polymorphs at high pressures and temperatures by energy-dispersive spectra of powder diffraction Note: P = 3.55 GPa T = 293 K Note: quartz structure Journal of Applied Crystallography, 1991, 24, 111-118 |
| 9014265 | CIF | As Cu S | P n m a | 11.356; 3.754; 5.453 90; 90; 90 | 232.464 | Marumo, F.; Nowacki, W. The crystal structure of lautite and of sinnerite, a new mineral from the Lengenbach Quarry Schweizerische Mineralogische und Petrographische Mitteilungen, 1964, 44, 439-454 |
| 9014266 | CIF | Al2 Ca0.375 H4 O10 Si2 Sr0.625 | P 1 21/m 1 | 5.3849; 13.2377; 5.8489 90; 124.35; 90 | 344.221 | Liebscher, A.; Dorsam, G.; Franz, G.; Wunder, B.; Gottschalk, M. Crystal chemistry of synthetic lawsonite solid-solution series CaAl2 [(OH)2/(Si2O7)](H2O)-SrAl2[(OH)2/(Si2O7)](H2O) and the Cmcm-P2_1/m phase transition Note: Run #AU47 American Mineralogist, 2010, 95, 724-735 |
| 9014267 | CIF | Be O | P 63 m c | 2.6776; 2.6776; 4.3454 90; 90; 120 | 26.981 | Hazen, R. M.; Finger, L. W. High-pressure and high-temperature crystal chemistry of beryllium oxide Note: P = 5.0 GPa Journal of Applied Physics, 1986, 59, 3728-3733 |
| 9014269 | CIF | Cr2 O3 | R -3 c :H | 4.9233; 4.9233; 13.4953 90; 90; 120 | 283.286 | Finger, L. W.; Hazen, R. M. Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars Note: P = 40.6 kbar Journal of Applied Physics, 1980, 51, 5362-5367 |
| 9014270 | CIF | Fe9.966 Na1.608 O17.97 Zn0.99 | R -3 m :H | 5.9401; 5.9401; 35.731 90; 90; 120 | 1091.85 | Nicolopoulos, S.; Vincent, H.; Anne, M.; Joubert, J. Variation in crystal structure, ionic conductivity and magnetic properties with the water uptake of a new hydrated sodium beta ferrite _cod_database_code 1008479 Journal of Solid State Chemistry, 1990, 87, 298-307 |
| 9014271 | CIF | Al2 Ca0.07 F2 Fe0.04 H10 Mg0.01 Mn0.87 O13 P2 Zn0.01 | P -1 | 9.887; 9.796; 6.054 92.7; 99.83; 97.1 | 571.913 | Birch, W. D.; Grey, I. E.; Mills, S. J.; Pring, A.; Bougerol, C.; Ribabldi-Tunnicliffe A; Wilson, N. C.; Keck, E. Nordgauite, MnAl2(PO4)2(F,OH)2*5H2O, a new mineral from the Hagendorf-Sud pegmatite, Bavaria, Germany: description and crystal structure Mineralogical Magazine, 2011, 75, 269-278 |
| 9014273 | CIF | Ba O3 Ti | P 4 m m | 3.986; 3.986; 4.026 90; 90; 90 | 63.966 | Shirane, G.; Danner, H.; Pepinsky, R. Neutron diffraction study of orthorhombic BaTiO3 Note: tetragonal structure Physical Review, 1957, 105, 856-860 |
| 9014275 | CIF | Ca3 O9 Si2 Ti0.14 Zr0.86 | P 1 21/a 1 | 10.432; 10.163; 7.356 90; 90.96; 90 | 779.777 | Biagioni, C.; Bonaccorsi, E.; Perchiazzi, N.; Merlino, S. Single crystal refinement of the structure of baghdadite from Fuka (Okayama Prefecture, Japan) Periodico di Mineralogia, 2010, 79, 1-9 |
| 9014276 | CIF | Ca3.44 Ce0.5 F2.96 Fe0.02 Gd0.04 La0.16 Mn0.02 Na2.3 Nb0.34 Nd0.24 O15.04 Pr0.06 Si4 Sm0.04 Sr0.02 Ti0.6 Y0.08 Zr0.06 | P 1 21/c 1 | 7.4414; 5.6628; 18.8315 90; 101.383; 90 | 777.934 | Camara, F.; Sokolova, E.; Hawthorne, F. C. From structure topology to chemical composition. XII. Titanium silicates: the crystal chemistry of rinkite, Na2Ca4REETi(Si2O7)2OF3 Note: sample 2909 Mineralogical Magazine, 2011, 75, 2755-2774 |
| 9014277 | CIF | Cu2.937 H26 O34 S2 U4 | P -1 | 8.6744; 8.8692; 10.009 72.105; 70.544; 76.035 | 682.606 | Plasil, J.; Fejfarova, K.; Wallwork, K. S.; Dusek, M.; Skoda, R.; Sejkora, J.; Cejka, J.; Veselovsky, F.; Hlousek, J.; Meisser, N.; Brugger, J. Crystal structure of pseudojohannite, with a revised formula, Cu3(OH)2[(UO2)4O4(SO4)2](H2O)12 American Mineralogist, 2012, 97, 1796-1803 |
| 9014278 | CIF | H6 Mg3.592 O19 Si6 | P n c n | 13.2608; 27.0559; 5.2671 90; 90; 90 | 1889.74 | Sanchez, M.; Garcia-Romero E; Suarez, M.; Silva, I.; Fuentes-Montero L; Martinez-Criado G Variability in sepiolite: Diffraction studies Note: Sample BAT225 Note: T = 225 C American Mineralogist, 2011, 96, 1443-1454 |
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