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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9016554 | CIF | As0.024 Ca2.19 Mn1.978 Na0.81 O12 Si0.21 V2.781 | I a -3 d | 12.5433; 12.5433; 12.5433 90; 90; 90 | 1973.49 | Nagashima, M.; Armbruster, T. Palenzonaite, berzeliite, and manganberzeliite:(As5+,V5+,Si4+)O4 tetrahedra in garnet structures Mineralogical Magazine, 2012, 76, 1081-1097 |
| 9016558 | CIF | O3 Si Sr | P 1 21/c 1 | 7.452; 6.066; 13.479 90; 117.09; 90 | 542.457 | Machida, K. I.; Adachi, G. Y.; Shiokawa, J.; Shimada, M.; Koizumi, M.; Suito, K.; Onodera, A. High-pressure synthesis, crystal structures, and luminescences properties of europium(II) metasilicate and europium(II)-activated calcium and strontium metasilicates Note: known as the delta-prime-phase Inorganic Chemistry, 1982, 21, 1512-1519 |
| 9016559 | CIF | Al2 Ca H15.68 O11.84 | P 63/m | 16.387; 16.387; 8.279 90; 90; 120 | 1925.34 | Guirado, F.; Gali, S.; Chinchon, S.; Rius, J. Crystal structure solution of hydrated high-alumina cement from X-ray powder diffraction data Angewandte Chemie, 1998, 37, 72-75 |
| 9016560 | CIF | Ba Pd | C 1 2/c 1 | 11.95; 13.82; 6.71 90; 103.63; 90 | 1076.94 | de Rassenfosse, A.; Pierard, J. Etude cristallographique du palladocyanure de baryum. BaPd(CN)4(H2O)4 _cod_database_code 1010798 Bulletin de la Societe Royal des Sciences de Liege, 1935, 4, 74-79 |
| 9016561 | CIF | Al4 B10.68 Be5.32 Cs0.34 K0.34 O28 Rb0.17 | P -4 3 m | 7.3094; 7.3094; 7.3094 90; 90; 90 | 390.522 | Gatta, G. D.; Vignola, P.; McIntyre, G. J.; Diella, V. On the crystal chemistry of londonite [(Cs,K,Rb)Al4Be5B11O28]: a single-crystal neutron diffraction study at 300 and 20 K Note: neutron diffraction study at T = 20 K American Mineralogist, 2010, 95, 1467-1472 |
| 9016562 | CIF | C Fe O3 | R -3 c :H | 4.368; 4.368; 12.75 90; 90; 120 | 210.672 | 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 P20-2, P = 47.2 GPa Physical Review B, 2010, 82, 064110-064118 |
| 9016563 | CIF | Cr2 O3 | R -3 c :H | 4.8273; 4.8273; 13.264 90; 90; 120 | 267.679 | 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 = 20.4 GPa American Mineralogist, 2012, 97, 1764-1770 |
| 9016564 | CIF | Al1.461 Fe0.538 Mg1.001 O4 | F d -3 m :2 | 8.1696; 8.1696; 8.1696 90; 90; 90 | 545.258 | 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 550 C Annealing time = 360 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9016567 | CIF | Fe Ge2 Li O6 | C 1 2/c 1 | 9.4; 8.64; 5.075 90; 100.91; 90 | 404.721 | Nestola, F.; Redhammer, G. J.; Pamato, M. G.; Secco, L.; Dal Negro, A. High-pressure phase transformation in LiFeGe2O6 pyroxene Note: P = 8.72 GPa American Mineralogist, 2009, 94, 616-621 |
| 9016570 | CIF | Al2 Mg3 O12 Si3 | I a -3 d | 11.4801; 11.4801; 11.4801 90; 90; 90 | 1512.99 | 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 = 523.0 K American Mineralogist, 2011, 96, 1593-1605 |
| 9016572 | CIF | Fe0.087 Mg0.913 O3 Si | P b c a | 17.868; 8.491; 5.0565 90; 90; 90 | 767.158 | Zhang, J. S.; Dera, P.; Bass, J. D. A new high-pressure phase transition in natural Fe-bearing orthoenstatite Note: P = 12.66 GPa American Mineralogist, 2012, 97, 1070-1074 |
| 9016573 | CIF | Ca2 K O23 P5 | P n a 21 | 14.773; 15.758; 19.91409 90; 90; 90 | 4635.86 | Averbuch-Pouchot M; Durif, A.; Schuelke, U. The calcium-potassium cyclodecaphosphate hexadecahydrate: Ca4K2P10O30*16(H2O) _cod_database_code 1007233 European Journal of Solid State and Inorganic Chemistry, 1996, 33, 1091-1100 |
| 9016574 | CIF | Fe Ge O3 | C 1 2/c 1 | 9.784; 9.1342; 5.1924 90; 101.754; 90 | 454.309 | 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 = 30 K American Mineralogist, 2012, 97, 694-706 |
| 9016575 | CIF | C0.88 H2 Al3 Ca0.438 Na3.522 O15.64 Si3 | P 63 | 12.5976; 12.5976; 5.1168 90; 90; 120 | 703.242 | Lotti, P.; Gatta, G. D.; Rotiroti, N.; Camara, F. High-pressure study of a natural cancrinite Note: P = 0.0001 GPa (P-AIR) American Mineralogist, 2012, 97, 872-882 |
| 9016577 | CIF | Al1.609 Fe0.391 Mg 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 650 C Annealing time = 0 min European Journal of Mineralogy, 2012, 24, 633-643 |
| 9016578 | CIF | C H6.96 Al6 K0.36 Na7.561 O30.48 Si6 | P 3 1 c | 12.6678; 12.6678; 10.3401 90; 90; 120 | 1437 | Khomyakov, A. P.; Camara, F.; Sokolova, E. Carbobystrite, Na8[Al6Si6O24](CO3)*4H2O, a new cancrinite-group mineral species from the Khibina Alkaline massif, Kola Peninsula, Russia: Description and crystal structure The Canadian Mineralogist, 2010, 48, 291-300 |
| 9016581 | CIF | As Fe H4 O6 | P c a b | 8.937; 10.278; 9.996 90; 90; 90 | 918.177 | Hawthorne, F. C. The hydrogen positions in scorodite Acta Crystallographica, Section B, 1976, 32, 2891-2892 |
| 9016583 | CIF | Al7.203 B3 Ca0.63 F0.69 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, disordered model The Canadian Mineralogist, 2011, 49, 63-88 |
| 9016584 | CIF | C Fe3 | P n m a | 5.09; 6.748; 4.523 90; 90; 90 | 155.353 | Herbstein, F. H.; Smuts, J. Comparison of X-ray and neutron-diffraction refinements of the structure of cementite Fe3C Acta Crystallographica, 1964, 17, 1331-1332 |
| 9016585 | CIF | B20 H26 O | C 1 2/c 1 | 24.838; 6.816; 10.132 90; 98.43; 90 | 1696.77 | Greenwood, N. N.; McDonald, W. S.; Spalding, T. R. Crystal and molecular structure of 6,6 bis(nido-decaboranyl) oxide (B10H13)2O Journal of the Chemical Society, Dalton Transactions, Inorganic Chemistry, 1980, 1980, 1251-1252 |
| 9016586 | CIF | Al6.24 B3.09 F0.19 Fe1.939 H3.41 Li0.021 Mg0.7 Na0.96 O30.81 Si5.802 Ti0.208 | R 3 m :H | 15.99; 15.99; 7.195 90; 90; 120 | 1593.16 | Grice, J. D.; Ercit, T. S. Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Shorl 49356 Neues Jahrbuch fur Mineralogie, Abhandlungen, 1993, 165, 245-266 |
| 9016592 | CIF | C Ba0.981 O3 Sr0.019 | P m c n | 5.3193; 8.9056; 6.4353 90; 90; 90 | 304.85 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K American Mineralogist, 2012, 97, 707-712 |
| 9016593 | CIF | Ba0.001 Fe0.001 O4 S Sr0.966 | P b n m | 6.87032; 8.3603; 5.34732 90; 90; 90 | 307.139 | Antao, S. M. Structural trends for celestite (SrSO4), anglesite (PbSO4), and barite (BaSO4): confirmation of expected variations within SO4 groups American Mineralogist, 2012, 97, 661-665 |
| 9016594 | CIF | Fe0.665 H1.072 K Mg2.335 O12 Si4 | C 1 2/m 1 | 5.3369; 9.2355; 10.2267 90; 100.05; 90 | 496.329 | Scordari, F.; Schingaro, E.; Ventruti, G.; Lacalamita, M.; Ottolini, L. Red micas from basal ignimbrites of Mt. Vulture (Italy): interlayer content appraisal by a multi-methodic approach Note: Sample LC7_R2 Physics and Chemistry of Minerals, 2008, 35, 163-174 |
| 9016596 | CIF | Al Ge2 Li O6 | P 1 21/n 1 | 9.9015; 8.4047; 5.4036 90; 110.637; 90 | 420.828 | Redhammer, G. J.; Nestola, F.; Miletich, R. Synthetic LiAlGe2O6: The first pyroxene with P2_1/n symmetry Note: Sample #LAG American Mineralogist, 2012, 97, 1213-1218 |
| 9016597 | CIF | C Ca0.997 O3 Sr0.003 | P m c n | 4.9564; 7.9536; 5.7253 90; 90; 90 | 225.698 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 224 K American Mineralogist, 2012, 97, 707-712 |
| 9016598 | CIF | Mg2 O4 Si | I m m a | 5.7214; 11.4789; 8.2924 90; 90; 90 | 544.607 | Trots, D. M.; Kurnosov, A.; Ballaran, T. F.; Frost, D. J. High-temperature structural behaviors of anhydrous wadsleyite and forsterite Note: T = 728 K American Mineralogist, 2012, 97, 1582-1590 |
| 9016599 | CIF | C Fe O3 | R -3 c :H | 4.575; 4.575; 14.29 90; 90; 120 | 259.027 | 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 P7, P = 18.82 GPa Physical Review B, 2010, 82, 064110-064118 |
| 9016600 | CIF | C Ca O3 | P m c n | 4.9744; 8.0432; 5.83 90; 90; 90 | 233.259 | 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 = 420 C Note: P = 101 kPa The Canadian Mineralogist, 2010, 48, 1225-1236 |
| 9016602 | CIF | Fe2.48 Mg0.09 O4 Si0.43 | I m m a | 5.8506; 17.9793; 8.3779 90; 90; 90 | 881.269 | Woodland, A. B.; Angel, R. J.; Koch, M. Structural systematics of spinel and spinelloid phases in the system MFe2O4-M2SiO4 with M = Fe2+ and Mg Sample: 4f8b1195, Spinelloid-II European Journal of Mineralogy, 2012, 24, 657-668 |
| 9016604 | CIF | C Ca0.001 O3 Pb | P m c n | 5.182; 8.4953; 6.1436 90; 90; 90 | 270.458 | Ye, Y.; Smyth, J. R.; Boni, P. Crystal structure and thermal expansion of aragonite-group carbonates by single-crystal X-ray diffraction Note: T = 300 K American Mineralogist, 2012, 97, 707-712 |
| 9016605 | CIF | Fe0.96 Si2 | C m c e | 9.8362; 7.8301; 7.8655 90; 90; 90 | 605.788 | Li, G.; Sh, N.; Xiong, M.; Ma, Z.; Bai, W.; Fang, Q. Rietveld structure refinement of new mineral luobusaite (beta-FeSi2) Journal of Mineralogy and Petrology, 2007, 27, 1-5 |
| 9016606 | CIF | As0.5 Ca Cu H O5 P0.5 | P 21 21 21 | 7.328; 9.123; 5.769 90; 90; 90 | 385.677 | Schluter, J.; Pohl, D.; Gebhard, G. The new mineral hermannroseite, CaCu(PO4,AsO4)(OH), the phosphate analogue of conichalcite, from Tsumeb, Namibia Neues Jahrbuch fur Mineralogie, Abhandlungen, 2011, 188, 135-140 |
| 9016609 | CIF | Cr2 O3 | R -3 c :H | 4.951; 4.951; 13.5656 90; 90; 120 | 287.975 | Finger, L. W.; Hazen, R. M. Crystal structure and isothermal compression of Fe2O3, Cr2O3, and V2O3 to 50 kbars Note: P = 0.001 kbar Journal of Applied Physics, 1980, 51, 5362-5367 |
| 9016611 | CIF | H2 O | P n -3 m :1 | 3.3; 3.3; 3.3 90; 90; 90 | 35.937 | Kamb, B.; Davis, B. L. Ice VII, the densest form of ice Note: T = 223 K, P = 2.5 GPa Proceedings of the National Academy of Sciences, 1964, 52, 1433-1439 |
| 9016612 | CIF | As6.36 H3.56 K1.61 N0.39 O S13 Sb1.64 | P -1 | 9.704; 11.579; 12.102 112.82; 103.44; 90.49 | 1211.64 | Biagioni, C.; Bonaccorsi, E.; Pasero, M.; Moelo, Y.; Ciriotti, M. E.; Bersani, D.; Callegari, A. M.; Boiocchi, M. Ambrinoite, (K,NH4)2(As,Sb)8S13*H2O, a new mineral from Upper Susa Valley, Piedmont, Italy: The first natural (K,NH4)-hydrated sulfosalt American Mineralogist, 2011, 96, 878-887 |
| 9016613 | CIF | C0.805 H1.998 Al2.91 Ca0.81 Na2.915 O15.414 Si3.09 | P 63 | 12.613; 12.613; 5.124 90; 90; 120 | 705.954 | 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# mmf62633/2 The Canadian Mineralogist, 2012, 49, 1129-1150 |
| 9016614 | CIF | Dy0.239 H52 O66 S4 U8 Y1.98 | P -1 | 14.0743; 17.4174; 17.7062 75.933; 128.001; 74.419 | 2776.99 | Plasil, J.; Dusek, M.; Novak, M.; Cejka, J.; Cisarova, I.; Skoda, R. Sejkoraite-(Y), a new member of the zippeite group containing trivalent cations from Jachymov (St. Joachimsthal), Czech Republic: Description and crystal structure refinement American Mineralogist, 2011, 96, 983-991 |
| 9016616 | CIF | Ag16 As4 Cu0.213 Hg0.786 S15 | C 1 2 1 | 26.03; 15.059; 15.524 90; 90.45; 90 | 6085 | Bindi, L.; Downs, R. T.; Spry, P. G.; Pinch, W. W.; Menchetti, S. A chemical and structural re-examination of fettelite samples from the type locality, Odenwald, southwest Germany Sample: R110042 Mineralogical Magazine, 2012, 76, 551-566 |
| 9016617 | CIF | Fe0.6 Mn1.4 O4 Si | P b n m | 4.8789; 10.60587; 6.20468 90; 90; 90 | 321.061 | Redfern, S. A. T.; Knight, K. S.; Henderson, C. M. B.; Wood, B. J. Fe-Mn cation ordering in fayalite-tephroite (FexMn1-x)2SiO4 olivines: A neutron diffraction study Mineralogical Magazine, 1998, 62, 607-615 |
| 9016618 | CIF | C Na1.959 O3 | C 1 2/m 1 | 8.825; 5.194; 5.953 90; 101.83; 90 | 267.072 | Arakcheeva, A.; Bindi, L.; Pattison, P.; Meisser, N.; Chapuis, G.; Pekov, I. The incommensurately modulated structures of natural natrite at 120 and 293 K from synchrotron X-ray data T = 120 K American Mineralogist, 2010, 95, 574-581 |
| 9016619 | CIF | Al K0.986 O4 Si | P 3 1 c | 5.1652; 5.1652; 8.7326 90; 90; 120 | 201.766 | Gatta, G. D.; Angel, R. J.; Carpenter, M. A. Low-temperature behavior of natural kalsilite with P31c symmetry: An in situ single-crystal X-ray diffraction study T = 275 K American Mineralogist, 2010, 95, 1027-1034 |
| 9016620 | CIF | Ca4.68 Ce11.4 Cs6 F6.76 Gd0.24 H46.02 K2.22 La5.82 Nd3.18 O203.11 Pr1.56 Si70 Sm0.36 Sr1.02 | P m -3 | 21.9148; 21.9148; 21.9148 90; 90; 90 | 10524.8 | Sokolova, E.; Hawthorne, F. C.; Pautov, L. A.; Agakhanov, A. A.; Karpenko, V. Y. The crystal structure and crystal chemistry of mendeleevite-(Ce), (Cs,_)6(_,Cs)6(_,K)6(REE,Ca,_)30(Si70O175)(H2O,OH,F,_)35, a potential microporous material Tien-Shan mountains, northern Tajikistan Mineralogical Magazine, 2011, 75, 2583-2596 |
| 9016621 | CIF | Cl Cr2 F H2 O10 Pb4 | P m m n :2 | 7.6256; 11.6081; 6.8961 90; 90; 90 | 610.434 | Cooper, M. A.; Ball, N. A.; Hawthorne, F. C.; Paar, W. H.; Roberts, A. C.; Moffatt, E. Georgerobinsonite, Pb4(CrO4)2(OH)2FCl, a new chromate mineral from the Mammoth-St. Anthony mine, Tiger, Pinal County, Arizona: description and crystal structure The Canadian Mineralogist, 2011, 49, 865-876 |
| 9016624 | CIF | Ba O3 Ti | R 3 m :R | 4.0042; 4.0042; 4.0042 89.836; 89.836; 89.836 | 64.201 | Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 100 K Journal of Physical Chemistry, 1993, 97, 2368-2377 |
| 9016625 | CIF | Mg1.88 O4 Si0.97 | F d -3 m :2 | 8.0947; 8.0947; 8.0947 90; 90; 90 | 530.398 | Ye, Y.; Brown, D. A.; Smyth, J. R.; Panero, W. R.; Jacobsen, S. D.; Chang, Y. Y.; Townsend, J. P.; Thomas, S. M.; Hauri, E. H.; Dera, P.; Frost, D. J. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H2O Note: at room T after heating to T = 635 K, split Si model American Mineralogist, 2012, 97, 573-582 |
| 9016626 | CIF | Fe H10 N O11 S2 | P 1 21/c 1 | 9.982; 10.156; 9.504 90; 94.95; 90 | 959.895 | Palmer, K. J.; Wong, R. Y.; Lee, K. S. The crystal structure of ferric ammonium sulfate trihydrate, FeNH4(SO4)2*3H2O Note: y-coordinate of O10 altered to reproduce reported bond lengths Acta Crystallographica, Section B, 1972, 28, 236-241 |
| 9016627 | CIF | Cl Cu2 D3 O3 | P 1 21/n 1 | 6.15175; 6.81606; 9.10541 90; 99.8394; 90 | 376.18 | Wills, A. S.; Henry, J. Y. On the crystal and magnetic ordering structures of clinoatacamite, gamma-Cu2(OD)3Cl, a proposed valence bond solid Journal of Physics: Condensed Matter, 2008, 20, 472206-472208 |
| 9016628 | CIF | Ca2 Fe2 O5 | P n m a | 5.3744; 14.6175; 5.5526 90; 90; 90 | 436.214 | 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 = 3.863 GPa Physics and Chemistry of Minerals, 2008, 35, 493-504 |
| 9016629 | CIF | Cl10 Cu4 K4 O | C 1 2/c 1 | 14.74; 14.9; 8.948 90; 104.79; 90 | 1900.1 | Semenova, T. F.; Rozhdestvenskaya, I. V.; Filatov, S. K.; Verasova, L. P. Crystal structure of a new mineral ponomarevite, K4Cu4OCl10 Doklady Akademii Nauk SSSR, 1989, 304, 427-430 |
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