Crystallography Open Database
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Searching space group like 'P 1 21/c 1'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
9004696 | CIF | B5 Ca2 H7 O13 | P 1 21/c 1 | 11.623; 6.976; 12.35 90; 110.7; 90 | 936.719 | Wallwork, K. S.; Pring, A.; Taylor, M. R.; Hunter, B. A. The structure of priceite, a basic hydrated calcium borate, by ab initio powder-diffraction methods The Canadian Mineralogist, 2002, 40, 1199-1206 |
9004735 | CIF | Ba3.694 Ca2.306 H32 O64 P6 U9 | P 1 21/c 1 | 10.092; 17.245; 17.355 90; 113.678; 90 | 2766.14 | Locock, A. J.; Burns, P. C. The crystal structure of bergenite, a new geometrical isomer of the phosphuranylite group The Canadian Mineralogist, 2003, 41, 91-101 |
9004761 | CIF | H22 Mg2 O31 S2 U4 | P 1 21/c 1 | 8.6457; 17.2004; 18.4642 90; 102.119; 90 | 2684.61 | Burns, P. C.; Deely, K. M.; Hayden, L. A. The crystal chemistry of the zippeite group Sample: SZIPPMg The Canadian Mineralogist, 2003, 41, 687-706 |
9004773 | CIF | Fe H14 O11 S | P 1 21/c 1 | 14.04; 6.502; 10.952 90; 105.81; 90 | 961.966 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: melant8 Locality: Richmond mine, Iron Mountain, California The Canadian Mineralogist, 2003, 41, 937-949 |
9004774 | CIF | Cu0.2 Fe1.8 H28 O22 S2 | P 1 21/c 1 | 14.06; 6.505; 10.943 90; 105.75; 90 | 963.273 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: M10b The Canadian Mineralogist, 2003, 41, 937-949 |
9004775 | CIF | Cu0.415 Fe1.535 H28 O22 S2 Zn0.05 | P 1 21/c 1 | 14.071; 6.505; 10.958 90; 105.69; 90 | 965.633 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: 98-rp-53 The Canadian Mineralogist, 2003, 41, 937-949 |
9004776 | CIF | Cu0.48 Fe1.52 H28 O22 S2 | P 1 21/c 1 | 14.079; 6.505; 10.947 90; 105.77; 90 | 964.833 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: n73 The Canadian Mineralogist, 2003, 41, 937-949 |
9004777 | CIF | Cu0.172 Fe1.303 H28 O22 S2 Zn0.525 | P 1 21/c 1 | 14.081; 6.51; 10.997 90; 105.63; 90 | 970.789 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: m2 The Canadian Mineralogist, 2003, 41, 937-949 |
9004778 | CIF | Cu0.78 Fe1.22 H28 O22 S2 | P 1 21/c 1 | 14.077; 6.497; 10.949 90; 105.81; 90 | 963.495 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: m40a The Canadian Mineralogist, 2003, 41, 937-949 |
9004779 | CIF | Cu0.14 Fe1.212 H28 O22 S2 Zn0.648 | P 1 21/c 1 | 14.052; 6.496; 11.026 90; 105.61; 90 | 969.35 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: 98-rp-36 The Canadian Mineralogist, 2003, 41, 937-949 |
9004780 | CIF | Cu0.45 Fe1.117 H28 O22 S2 Zn0.433 | P 1 21/c 1 | 14.08; 6.498; 10.955 90; 105.65; 90 | 965.136 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: mati-19 The Canadian Mineralogist, 2003, 41, 937-949 |
9004781 | CIF | Cu0.203 Fe0.965 H28 O22 S2 Zn0.832 | P 1 21/c 1 | 14.073; 6.51; 10.954 90; 105.62; 90 | 966.491 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: mati-6 The Canadian Mineralogist, 2003, 41, 937-949 |
9004782 | CIF | Cu0.682 Fe0.706 H28 O22 S2 Zn0.612 | P 1 21/c 1 | 14.1; 6.518; 10.886 90; 105.76; 90 | 962.855 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: mati-7 The Canadian Mineralogist, 2003, 41, 937-949 |
9004783 | CIF | Cu0.079 Fe0.688 H28 O22 S2 Zn1.232 | P 1 21/c 1 | 14.066; 6.506; 10.938 90; 105.58; 90 | 964.194 | Peterson, R. C. The relatinship between Cu content and distortion in the atomic structure of melanterite from the Richmond mine, Iron Mountain, California Sample: 91rs209c The Canadian Mineralogist, 2003, 41, 937-949 |
9004909 | CIF | Cs2 H2 Mo2 O11 U | P 1 21/c 1 | 8.222; 11.0993; 13.9992 90; 95.155; 90 | 1272.38 | Krivovichev, S. V.; Burns, P. C. Crystal chemistry of the uranyl molybdates. XI. Crystal structures of Cs2[(UO2)(MoO4)2] and Cs2[(UO2)(MoO4)2](H2O) The Canadian Mineralogist, 2005, 43, 713-720 |
9004915 | CIF | Ba H14 O18 P2 U2 | P 1 21/c 1 | 9.882; 16.868; 9.789 90; 90.52; 90 | 1631.66 | Locock A J; Burns P C; Flynn T M Structures of strontium- and barium-dominant compounds that contain the autunite-type sheet The Canadian Mineralogist, 2005, 43, 721-733 |
9004951 | CIF | As2 Co Fe2 H12 O14 | P 1 21/c 1 | 10.2635; 9.7028; 5.5711 90; 94.207; 90 | 553.301 | Kampf, A. R. The crystal structure of cobaltarthurite from the Bou Azzer district, Morocco: The location of hydrogen atoms in the arthurite structure-type The Canadian Mineralogist, 2005, 43, 1387-1391 |
9004952 | CIF | H8 Mn7 O16 P2 | P 1 21/c 1 | 11.364; 5.57; 10.455 90; 96.61; 90 | 657.376 | Pring, A.; Kolitsch, U.; Birch, W. D. Description and unique crystal-structure of waterhouseite, a new hydroxy manganese phosphate species from the Iron Monarch deposit, Middleback Ranges, South Australia The Canadian Mineralogist, 2005, 43, 1401-1410 |
9004956 | CIF | Ca0.4 Mg1.6 O6 Si2 | P 1 21/c 1 | 9.7042; 8.8805; 5.2423 90; 108.084; 90 | 429.455 | Tribaudino, M.; Nestola, F.; Meneghini, C. Rietveld refinement of clinopyroxenes with intermediate Ca-content along the join diopside-enstatite Sample: Di40En60 The Canadian Mineralogist, 2005, 43, 1411-1421 |
9004957 | CIF | Ca0.2 Mg1.8 O6 Si2 | P 1 21/c 1 | 9.6655; 8.8534; 5.2138 90; 108.349; 90 | 423.474 | Tribaudino, M.; Nestola, F.; Meneghini, C. Rietveld refinement of clinopyroxenes with intermediate Ca-content along the join diopside-enstatite Sample: Di20En80 The Canadian Mineralogist, 2005, 43, 1411-1421 |
9004980 | CIF | Ba O6 Ti U | P 1 21/c 1 | 6.4463; 8.5999; 10.2532 90; 75.936; 90 | 551.374 | Wallwork, K. S.; James, M.; Carter, M. L. The crystal chemistry, structure and properties of a synthetic carnotite-type compound, Ba2[(UO2)2Ti2O8] The Canadian Mineralogist, 2006, 44, 433-442 |
9004986 | CIF | Ag0.1 Cu1.9 Pd3 Se4 | P 1 21/c 1 | 5.672; 9.909; 6.264 90; 115.4; 90 | 318.029 | Topa, D.; Makovicky, E.; Balic-Zunic T The crystal structures of jagueite, Cu2Pd3Se4, and chrisstanleyite, Ag2Pd3Se4 The Canadian Mineralogist, 2006, 44, 497-505 |
9004987 | CIF | Ag1.592 Cu0.4 Pd3 Se4 | P 1 21/c 1 | 5.676; 10.342; 6.341 90; 114.996; 90 | 337.361 | Topa, D.; Makovicky, E.; Balic-Zunic T The crystal structures of jagueite, Cu2Pd3Se4, and chrisstanleyite, Ag2Pd3Se4 The Canadian Mineralogist, 2006, 44, 497-505 |
9005274 | CIF | Ca0.07 Mg1.131 Mn0.799 O6 Si2 | P 1 21/c 1 | 9.725; 8.876; 5.263 90; 108.53; 90 | 430.745 | Gnos, E.; Armbruster, T.; Nyfeler, D. Kanoite, donpeacorite and tirodite: Mn-Mg-silicates from a manganiferous quartzite in the United Arab Emirates Sample: pyroxene European Journal of Mineralogy, 1996, 8, 251-261 |
9005313 | CIF | Ca0.07 Mg1.109 Mn0.821 O6 Si2 | P 1 21/c 1 | 9.758; 8.897; 5.283 90; 108.74; 90 | 434.339 | Arlt, T.; Armbruster, T. The temperature-dependent P2_1/c - C2/c phase transition in the clinopyroxene kanoite MnMg[Si2O6]: a single-crystal X-ray and optical study T = 200 C European Journal of Mineralogy, 1997, 9, 953-964 |
9005462 | CIF | Al2 H44 Mg0.93 Mn0.07 O38 S4 | P 1 21/c 1 | 6.1844; 24.2715; 21.2265 90; 100.326; 90 | 3134.59 | Quartieri, S.; Triscari, M.; Viani, A. Crystal structure of the hydrated sulphate pickeringite (MgAl2(SO4)4.22H2O): X-ray powder diffraction study European Journal of Mineralogy, 2000, 12, 1131-1138 |
9005507 | CIF | Er0.466 O9 Si Ti2 Y1.534 | P 1 21/c 1 | 12.293; 11.124; 4.861 90; 95.69; 90 | 661.454 | Kolitsch, U. The crystal structure of trimounsite-(Y), (Y,REE)2Ti2SiO9: an unusual TiO6-based titanate chain European Journal of Mineralogy, 2001, 13, 761-768 |
9005509 | CIF | Ge S3 Sn | P 1 21/c 1 | 7.2704; 10.197; 6.8463 90; 105.34; 90 | 489.476 | Sejkora, J.; Berlepsch, P.; Makovicky, E.; Balic-Zunic T Natural SnGeS3 from Radvanice near Trutnov (Czech Republic): its description, crystal structure refinement and solid solution with PbGeS3 European Journal of Mineralogy, 2001, 13, 791-800 |
9005532 | CIF | K0.45 Na1.55 O5 Si2 | P 1 21/c 1 | 4.845; 8.647; 11.992 90; 90.31; 90 | 502.394 | Rakic, S.; Kahlenberg, V. The crystal structure of a mixed alkali phyllosilicate with composition Na1.55K0.45Si2O5 European Journal of Mineralogy, 2001, 13, 1215-1221 |
9005540 | CIF | Ba H16 Mg5 O24 P4 | P 1 21/c 1 | 8.3354; 12.8304; 18.313 90; 90.025; 90 | 1958.51 | Krivovichev, S. V.; Britvin, S. N.; Burns, P. C.; Yakovenchuk, V. N. Crystal structure of rimkorolgite, Ba[Mg5(H2O)7(PO4)4](H2O), and its comparison with bakhchisaraitsevite European Journal of Mineralogy, 2002, 14, 397-402 |
9005541 | CIF | Ca0.15 Mg1.85 O6 Si2 | P 1 21/c 1 | 9.654; 8.845; 5.203 90; 108.37; 90 | 421.642 | Tribaudino, M.; Nestola, F. Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di15En85 (non-split model) Note: x-coordinate for SiTA altered by Tribaudino, Sept 2003 European Journal of Mineralogy, 2002, 14, 549-555 |
9005542 | CIF | Ca0.15 Mg1.85 O6 Si2 | P 1 21/c 1 | 9.654; 8.845; 5.203 90; 108.37; 90 | 421.642 | Tribaudino, M.; Nestola, F. Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di15En85 (split model) European Journal of Mineralogy, 2002, 14, 549-555 |
9005543 | CIF | Ca0.23 Mg1.77 O6 Si2 | P 1 21/c 1 | 9.69; 8.862; 5.229 90; 108.31; 90 | 426.295 | Tribaudino, M.; Nestola, F. Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di23En77 (non-split model) European Journal of Mineralogy, 2002, 14, 549-555 |
9005544 | CIF | Ca0.23 Mg1.77 O6 Si2 | P 1 21/c 1 | 9.69; 8.862; 5.229 90; 108.31; 90 | 426.295 | Tribaudino, M.; Nestola, F. Average and local structure in P2_1/c clinopyroxenes along the join diopside-enstatite (CaMgSi2O6-Mg2Si2O6) Sample: Di23En77 (split model) European Journal of Mineralogy, 2002, 14, 549-555 |
9005571 | CIF | Ag3.112 Pb1.888 S8 Sb3 | P 1 21/c 1 | 17.852; 5.887; 15.809 90; 116.165; 90 | 1491.19 | Armbruster, T.; Makovicky, E.; Berlepsch, P.; Sejkora, J. Crystal structure, cation ordering, and polytypic character of diaphorite, Pb2Ag3Sb3S8, a PbS-based structure European Journal of Mineralogy, 2003, 15, 137-146 |
9005572 | CIF | Be3 H2 O6 Si | P 1 21/c 1 | 5.082; 4.64; 17.696 90; 106.13; 90 | 400.853 | Pekov, I. V.; Chukanov, N. V.; Larsen, A. O.; Merlino, S.; Pasero, M.; Pushcharovsky, D. Y.; Ivaldi, G.; Zadov, A. E.; Grishin, V. G.; Asheim, A.; Tafto, J.; Chistyakova, N. I. Sphaerobertrandite, Be3SiO4(OH)2: new data, crystal structure and genesis European Journal of Mineralogy, 2003, 15, 157-166 |
9005628 | CIF | Al0.033 Ca0.192 Fe0.854 Mg0.911 Mn0.027 Na0.003 O6 Si1.97 Ti0.01 | P 1 21/c 1 | 9.716; 8.948; 5.25 90; 108.49; 90 | 432.867 | Merli, M.; Camara, F. Topological analysis of the electron density of the clinopyroxene structure by the maximum entropy method: an exploratory study Sample: BTS-308 n.13 Note: Site occupancies are from personal communication with Camara, Dec 2003 European Journal of Mineralogy, 2003, 15, 903-911 |
9005629 | CIF | Ca0.15 Mg1.85 O6 Si2 | P 1 21/c 1 | 9.651; 8.846; 5.252 90; 108.38; 90 | 425.504 | Merli, M.; Camara, F. Topological analysis of the electron density of the clinopyroxene structure by the maximum entropy method: an exploratory study Sample: Dien2 Note: c-cell parameter changed by personal communication with author, Dec 2003 European Journal of Mineralogy, 2003, 15, 903-911 |
9005635 | CIF | Al1.97 H44 O38 S4 Zn0.954 | P 1 21/c 1 | 6.1757; 24.262; 21.206 90; 100.436; 90 | 3124.84 | Ballirano, P.; Bellatreccia, F.; Grubessi, O. New crystal-chemical and structural data of dietrichite, ideally ZnAl2(SO4)4*22H2O, a member of the halotrichite group European Journal of Mineralogy, 2003, 15, 1043-1049 |
9005671 | CIF | As2 Ca2 H4 Mg0.14 O10 Zn0.86 | P 1 21/c 1 | 5.827; 12.899; 5.646 90; 107.69; 90 | 404.301 | Keller, P.; Lissner, F.; Schleid, T. The crystal structures of zincroselite and gaitite: Two natural polymorphs of Ca2Zn[AsO4]2*2H2O from Tsumeb, Namibia European Journal of Mineralogy, 2004, 16, 353-359 |
9005737 | CIF | C Ca0.06 Ce F0.2 Fe0.67 La0.56 Mg0.21 Mn0.11 Na0.02 Nd0.24 O9.8 Pr0.08 Si2 Sm0.02 Ti0.01 | P 1 21/c 1 | 6.505; 6.744; 18.561 90; 108.75; 90 | 771.053 | Konev, A.; Pasero, M.; Pushcharovsky, D.; Merlino, S.; Kashaev, A.; Suvorova, L.; Ushchapovskaya, Z.; Nartova, N.; Lebedeva, Y.; Chukanov, N. Biraite-(Ce), Ce2Fe2+(CO3)(Si2O7), a new mineral from Siberia with a novel structure type European Journal of Mineralogy, 2005, 17, 715-721 |
9005739 | CIF | Mn6.95 Na2.119 O24 P6 | P 1 21/c 1 | 6.5291; 12.653; 10.952 90; 97.18; 90 | 897.679 | Yakubovich, O. V.; Massa, W.; Gavrilenko, P. G.; Dimitrova, O. V. The crystal structure of a new synthetic member in the wyllieite group: Na1.265Mn2+2.690Mn3+0.785(PO4)3 Note: Uiso's for Mn2 and Mn3 corrected by authors European Journal of Mineralogy, 2005, 17, 741-747 |
9005775 | CIF | Mg O3 Si | P 1 21/c 1 | 9.606; 8.8131; 5.17 90; 108.35; 90 | 415.429 | Ohashi, Y. Polysynthetically-twinned structures of enstatite and wollastonite Sample: CLEN Physics and Chemistry of Minerals, 1984, 10, 217-229 |
9005833 | CIF | O2 Zr | P 1 21/c 1 | 5.12; 5.216; 5.281 90; 99.01; 90 | 139.294 | Kudoh, Y.; Takeda, H.; Arashi, H. In situ determination of crystal structure for high pressure phase of ZrO2 using a diamond anvil and single crystal X-ray diffraction method Sample: P = 15 kbar Physics and Chemistry of Minerals, 1986, 13, 233-237 |
9006555 | CIF | Fe0.39 Mg0.61 O3 Si | P 1 21/c 1 | 9.6519; 8.9075; 5.2004 90; 108.59; 90 | 423.773 | Angel, R. J.; McCammon, C. A.; Woodland, A. B. Structure, ordering and cation interactions in Ca-free P2_1/c clinopyroxenes Sample: H162 Note: x coordinate of O2B changed by author, May, 2004 Physics and Chemistry of Minerals, 1998, 25, 249-258 |
9006912 | CIF | Al Li O6 Si2 | P 1 21/c 1 | 9.3114; 8.3614; 5.11 90; 109.274; 90 | 375.547 | Arlt, T.; Angel, R. J. Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 3.342 GPa Physics and Chemistry of Minerals, 2000, 27, 719-731 |
9006913 | CIF | Al Li O6 Si2 | P 1 21/c 1 | 9.2007; 8.2656; 5.024 90; 108.91; 90 | 361.451 | Arlt, T.; Angel, R. J. Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 8.835 GPa Physics and Chemistry of Minerals, 2000, 27, 719-731 |
9006915 | CIF | Li O6 Sc Si2 | P 1 21/c 1 | 9.6937; 8.8958; 5.3047 90; 109.992; 90 | 429.876 | Arlt, T.; Angel, R. J. Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 2.113 GPa Physics and Chemistry of Minerals, 2000, 27, 719-731 |
9006916 | CIF | Li O6 Sc Si2 | P 1 21/c 1 | 9.5954; 8.8304; 5.2448 90; 109.601; 90 | 418.646 | Arlt, T.; Angel, R. J. Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 4.804 GPa Physics and Chemistry of Minerals, 2000, 27, 719-731 |
9006918 | CIF | O3 Si Zn | P 1 21/c 1 | 9.5781; 8.8905; 5.1798 90; 109.443; 90 | 415.928 | Arlt, T.; Angel, R. J. Displacive phase transitions in C-centred clinopyroxenes: spodumene, LiScSi2O6 and ZnSiO3 Sample: P = 4.258 GPa Physics and Chemistry of Minerals, 2000, 27, 719-731 |
9006969 | CIF | Fe Li O6 Si2 | P 1 21/c 1 | 9.6223; 8.6638; 5.2655 90; 109.95; 90 | 412.62 | Redhammer, G. J.; Roth, G.; Paulus, W.; Andre, G.; Lottermoser, W.; Amthauer, G.; Treutmann, W.; Koppelhuber-Bitschnau B The crystal and magnetic structure of Li-aegirine LiFeSi2O6: a temperature-dependent study Sample: T = 100 K Pyroxene Physics and Chemistry of Minerals, 2001, 28, 337-346 |
9006970 | CIF | Fe Li O6 Si2 | P 1 21/c 1 | 9.635; 8.665; 5.275 90; 110; 90 | 413.836 | Redhammer, G. J.; Roth, G.; Paulus, W.; Andre, G.; Lottermoser, W.; Amthauer, G.; Treutmann, W.; Koppelhuber-Bitschnau B The crystal and magnetic structure of Li-aegirine LiFeSi2O6: a temperature-dependent study Sample: T = 200 K Pyroxene Physics and Chemistry of Minerals, 2001, 28, 337-346 |
9007013 | CIF | C2 H2 Cu3 O8 | P 1 21/c 1 | 5.011; 5.85; 10.353 90; 92.41; 90 | 303.223 | Belokoneva, E. L.; Gubina, Y. K.; Forsyth, J. B. The charge density distribution and antiferromagnetic properties of azurite Cu3[CO3]2(OH)2 Note: O1 x-coordinate altered Physics and Chemistry of Minerals, 2001, 28, 498-507 |
9007052 | CIF | Ca0.107 Fe0.416 Mg0.463 Mn0.014 O3 Si | P 1 21/c 1 | 9.719; 8.947; 5.251 90; 108.49; 90 | 433.035 | Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V. Non-convergent ordering and displacive phase transition in pigeonite: in situ HT XRD study Sample: hga, T = 25 C Physics and Chemistry of Minerals, 2002, 29, 331-340 |
9007053 | CIF | Ca0.106 Fe0.419 Mg0.461 Mn0.014 O3 Si | P 1 21/c 1 | 9.801; 9.008; 5.296 90; 109.01; 90 | 442.07 | Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V. Non-convergent ordering and displacive phase transition in pigeonite: in situ HT XRD study Sample: hgd, T = 650 C Physics and Chemistry of Minerals, 2002, 29, 331-340 |
9007054 | CIF | Ca0.107 Fe0.416 Mg0.464 Mn0.014 O3 Si | P 1 21/c 1 | 9.824; 9.017; 5.309 90; 109.19; 90 | 444.155 | Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V. Non-convergent ordering and displacive phase transition in pigeonite: in situ HT XRD study Sample: hgg, T = 750 C Physics and Chemistry of Minerals, 2002, 29, 331-340 |
9007055 | CIF | Ca0.107 Fe0.417 Mg0.462 Mn0.014 O3 Si | P 1 21/c 1 | 9.84; 9.021; 5.3184 90; 109.35; 90 | 445.429 | Camara, F.; Carpenter, M. A.; Domeneghetti, M. C.; Tazzoli, V. Non-convergent ordering and displacive phase transition in pigeonite: in situ HT XRD study Sample: hgi, T = 850 C Physics and Chemistry of Minerals, 2002, 29, 331-340 |
9007072 | CIF | Na2 O5 Si2 | P 1 21/c 1 | 4.8521; 23.9793; 8.141 90; 90.15; 90 | 947.202 | Rakic, S.; Kahlenberg, V.; Weidenthaler, C.; Zibrowius, B. Structural characterization of high-pressure C-Na2Si2O5 by single-crystal diffraction and 29Si MAS NMR Physics and Chemistry of Minerals, 2002, 29, 477-484 |
9007155 | CIF | Fe0.91 Li0.85 Mg0.24 O6 Si2 | P 1 21/c 1 | 9.638; 8.709; 5.258 90; 109.83; 90 | 415.172 | Camara, F.; Iezzi, G.; Oberti, R. HT-XRD study of synthetic ferrian magnesian spodumene: the effect of site dimension on the P2_1/c - C2/c phase transition Sample: T = 25 C Physics and Chemistry of Minerals, 2003, 30, 20-30 |
9007156 | CIF | Fe0.91 Li0.85 Mg0.24 O6 Si2 | P 1 21/c 1 | 9.651; 8.706; 5.27 90; 109.95; 90 | 416.222 | Camara, F.; Iezzi, G.; Oberti, R. HT-XRD study of synthetic ferrian magnesian spodumene: the effect of site dimension on the P2_1/c - C2/c phase transition Sample: T = 75 C Physics and Chemistry of Minerals, 2003, 30, 20-30 |
9007157 | CIF | Fe0.91 Li0.85 Mg0.24 O6 Si2 | P 1 21/c 1 | 9.672; 8.697; 5.281 90; 110.09; 90 | 417.195 | Camara, F.; Iezzi, G.; Oberti, R. HT-XRD study of synthetic ferrian magnesian spodumene: the effect of site dimension on the P2_1/c - C2/c phase transition Sample: T = 95 C Physics and Chemistry of Minerals, 2003, 30, 20-30 |
9007448 | CIF | O2 Zr | P 1 21/c 1 | 5.169; 5.232; 5.341 90; 99.25; 90 | 142.565 | McCullough, J. D.; Trueblood, K. N. The crystal structure of baddeleyite (monoclinic ZrO2) Acta Crystallographica, 1959, 12, 507-511 |
9007450 | CIF | Al2 H2 Mg O10 P2 | P 1 21/c 1 | 7.16; 7.26; 7.24 90; 120.67; 90 | 323.703 | Lindberg, M. L.; Christ, C. L. Crystal structures of the isostructural minerals lazulite, scorzalite and barbosalite Acta Crystallographica, 1959, 12, 695-697 |
9007451 | CIF | Al2 Fe H2 O10 P2 | P 1 21/c 1 | 7.15; 7.31; 7.25 90; 120.58; 90 | 326.23 | Lindberg, M. L.; Christ, C. L. Crystal structures of the isostructural minerals lazulite, scorzalite and barbosalite Acta Crystallographica, 1959, 12, 695-697 |
9007469 | CIF | Fe H8 O12 P2 Zn2 | P 1 21/c 1 | 10.23; 5.08; 10.49 90; 120.25; 90 | 470.919 | Kleber, W.; Liebau, F.; Piatkowiak, E. Zur struktur des phosphophyllits, Zn2Fe[PO4]2*4H2O Acta Crystallographica, 1961, 14, 795-795 |
9007482 | CIF | Fe H14 O11 S | P 1 21/c 1 | 14.072; 6.503; 11.041 90; 105.57; 90 | 973.287 | Baur, W. H. On the crystal chemistry of salt hydrates. III. The determination of the crystal structure of FeSO4*7H2O (melanterite) Locality: synthetic Acta Crystallographica, 1964, 17, 1167-1174 |
9007484 | CIF | Mg Na6 O16 S4 | P 1 21/c 1 | 9.797; 9.217; 8.199 90; 113.5; 90 | 678.956 | Fischer, W.; Hellner, E. Ueber die struktur des vanthoffits Acta Crystallographica, 1964, 17, 1613-1613 |
9007485 | CIF | O2 Zr | P 1 21/c 1 | 5.145; 5.2075; 5.3107 90; 99.23; 90 | 140.445 | Smith, D. K.; Newkirk, H. W. The crystal structure of baddeleyite (monoclinic ZrO2) and its relation to the polymorphism of ZrO2 Acta Crystallographica, 1965, 18, 983-991 |
9007491 | CIF | Al Ca F6 H2 Na O | P 1 21/c 1 | 5.583; 5.508; 16.127 90; 96.43; 90 | 492.804 | Cocco, G.; Castiglione, P. C.; Vagliasindi, G. The crystal structure of thomsenolite Acta Crystallographica, 1967, 23, 162-166 |
9007504 | CIF | As2 H8 O9 | P 1 21/c 1 | 7.6; 13.29; 8.24 90; 109.6; 90 | 784.049 | Worzala, H. Die kristallstruktur des arsensaurehydrates 2H3AsO4.H2O Acta Crystallographica, Section B, 1968, 24, 987-991 |
9007525 | CIF | Al0.089 Ca3.368 Ce1.048 F3 Fe0.212 K0.064 Na2.178 Nb0.327 O15 Si4 Ti0.515 Zr0.069 | P 1 21/c 1 | 7.437; 5.664; 18.843 90; 101.38; 90 | 778.122 | Galli, E.; Alberti, A. The crystal structure of rinkite Acta Crystallographica, Section B, 1971, 27, 1277-1284 |
9007550 | CIF | Ca Cu4 H12 O17 S2 | P 1 21/c 1 | 20.87; 6.135; 22.191 90; 102.73; 90 | 2771.44 | Sabelli, C.; Zanazzi, P. F. The crystal structure of devillite Note: z-coordinate of Cu7 altered to match reported bond lengths Acta Crystallographica, Section B, 1972, 28, 1182-1189 |
9007584 | CIF | H12 O16 S2 V2 | P 1 21/c 1 | 7.411; 7.439; 12.272 90; 108.9; 90 | 640.084 | Theobald, F.; Galy, J. Structure cristalline de VOSO4((H2O)3 Locality: synthetic Note: polymorph of bobjonesite Acta Crystallographica, Section B, 1973, 29, 2732-2736 |
9007600 | CIF | Co2 O7 V2 | P 1 21/c 1 | 6.594; 8.38; 9.47 90; 100.17; 90 | 515.069 | Sauerbrei, E. E.; Faggiani, R.; Calvo, C. Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7 Acta Crystallographica, Section B, 1974, 30, 2907-2909 |
9007601 | CIF | Ni2 O7 V2 | P 1 21/c 1 | 6.515; 8.303; 9.35 90; 99.86; 90 | 498.309 | Sauerbrei, E. E.; Faggiani, R.; Calvo, C. Cobalt vanadate, Co2V2O7, and nickel vanadate, Ni2V2O7 Note: x-coordinate of O7 altered to reproduce reported bond lengths Acta Crystallographica, Section B, 1974, 30, 2907-2909 |
9007608 | CIF | Cu H4 Na2 O10 S2 | P 1 21/c 1 | 5.807; 12.656; 5.517 90; 108.32; 90 | 384.912 | Hawthorne, F. C.; Ferguson, R. B. Refinement of the crystal structure of krohnkite Acta Crystallographica, Section B, 1975, 31, 1753-1755 |
9007612 | CIF | B3 H15 Mg O13 | P 1 21/c 1 | 6.8221; 13.1145; 12.035 90; 104.552; 90 | 1042.21 | Corazza, E. Inderite: Crystal structure refinement and relationship to kurnakovite Acta Crystallographica, Section B, 1976, 32, 1329-1333 |
9007620 | CIF | C4 H10 Mg5 O18 | P 1 21/c 1 | 10.105; 8.954; 8.378 90; 114.44; 90 | 690.118 | Akao, M.; Iwai, S. The hydrogen bonding of hydromagnesite Acta Crystallographica, Section B, 1977, 33, 1273-1275 |
9007626 | CIF | Al2 H18 O15 S | P 1 21/c 1 | 7.44; 15.583; 11.7 90; 110.18; 90 | 1273.2 | Sabelli, C.; Ferroni, R. T. The crystal structure of aluminite Note: anisotropic displacement factors from ICSD Acta Crystallographica, Section B, 1978, 34, 2407-2412 |
9007658 | CIF | B5 Ca H10 Na O14 | P 1 21/c 1 | 6.588; 12.56; 13.428 90; 99.97; 90 | 1094.32 | Menchetti, S.; Sabelli, C.; Trosti-Ferroni R Probertite, CaNa[B5O7(OH)4]*3H2O: a refinement Acta Crystallographica, Section B, 1982, 38, 3072-3075 |
9007684 | CIF | As2 Ni3 O8 | P 1 21/c 1 | 5.764; 9.559; 10.194 90; 92.95; 90 | 560.925 | Barbier, J.; Frampton, C. Structures of orthorhombic and monoclinic Ni3(AsO4)2 Note: AnisoU's taken from ICSD Acta Crystallographica, Section B, 1991, 47, 457-462 |
9007724 | CIF | C3 Cl Cu N O3 | P 1 21/c 1 | 5.192; 7.945; 16.51 90; 100.24; 90 | 670.197 | Norman, R. E.; Rose, N. J.; Stenkamp, R. E. Mono-amino-acid-copper complexes: syntheses and structures of chloro(glycinato)(methanol)copper(II) and chloro(glycinato)(1-methylimidazole)copper(II) Acta Crystallographica, Section C, 1990, 46, 1-6 |
9007745 | CIF | Cs H O4 S | P 1 21/c 1 | 8.214; 5.809; 10.984 90; 119.39; 90 | 456.651 | Itoh, K.; Ukeda, T.; Ozaki, T.; Nakamura, E. Redetermination of the structure of caesium hydrogensulfate Acta Crystallographica, Section C, 1990, 46, 358-361 |
9007770 | CIF | H14 N4 O6 Ru S2 | P 1 21/c 1 | 6.2019; 7.0213; 11.761 90; 115.3; 90 | 463.015 | Condren, S. M.; Cordes, A. W.; Durham, B. Structure of cis-tetraamminebis(hydrogensulfito)ruthenium(II) Acta Crystallographica, Section C, 1990, 46, 889-890 |
9007773 | CIF | Cr H16 N3 O10 P2 | P 1 21/c 1 | 7.825; 10.107; 15.322 90; 103.92; 90 | 1176.19 | Haromy, T. P.; Linck, C. F.; Cleland, W. W.; Sundaralingam, M. Structures of the meridional and facial isomers of triamminechromium pyrophosphate dihydrate Sample: a) meridional monoaquatriammine(pyrophosphato)-chromium(III) dihydrate Acta Crystallographica, Section C, 1990, 46, 951-957 |
9007774 | CIF | Cr H14 N3 O9 P2 | P 1 21/c 1 | 8.695; 10.327; 11.913 90; 97.81; 90 | 1059.79 | Haromy, T. P.; Linck, C. F.; Cleland, W. W.; Sundaralingam, M. Structures of the meridional and facial isomers of triamminechromium pyrophosphate dihydrate Sample: (b), alpha,beta,beta'-tridentate triammine(pyrophosphato) chromium(III)dihydrate dimer Acta Crystallographica, Section C, 1990, 46, 951-957 |
9007775 | CIF | Na2 O18 S3 Th | P 1 21/c 1 | 5.567; 16.81; 15.76 90; 91.925; 90 | 1474.01 | Habash, J.; Smith, A. J. Structure of disodium triaquatri-u-sulfato-thorate(IV) trihydrate Acta Crystallographica, Section C, 1990, 46, 957-960 |
9007787 | CIF | Mo5 O8 Sn | P 1 21/c 1 | 7.533; 9.268; 9.97 90; 109.73; 90 | 655.201 | Gougeon, P.; Potel, M.; Sergent, M. Structure of SnMo5O8 containing bioctahedral Mo10 clusters Acta Crystallographica, Section C, 1990, 46, 1188-1190 |
9007795 | CIF | C16 Br4 P2 Ta | P 1 21/c 1 | 8.493; 30.369; 8.898 90; 99.22; 90 | 2265.36 | Hovnanian, N.; Hubert-Pfalzgraf L G; Borgne, G. L. Structures of two polymorphs of cis-TaBr4(PhPMe2)2 Sample: 1 Acta Crystallographica, Section C, 1990, 46, 1207-1209 |
9007800 | CIF | H3 Na3 O5 Si | P 1 21/c 1 | 7.898; 5.96; 11.142 90; 105.57; 90 | 505.231 | Schmid, R. L.; Felsche, J. Structure of trisodium hydrogenorthosilicate monohydrate Acta Crystallographica, Section C, 1990, 46, 1365-1368 |
9007820 | CIF | C8 Cl2 Co2 O8 Sn | P 1 21/c 1 | 11.716; 11.486; 12.765 90; 108.42; 90 | 1629.78 | Mackay, K. M.; Nicholson, B. K.; Service, M. Structure of dichlorobis(tetracarbonylcobaltio)tin(IV)(2 Co-Sn) Acta Crystallographica, Section C, 1990, 46, 1759-1761 |
9007826 | CIF | C10 Cl4 N2 Na O5 Re S2 | P 1 21/c 1 | 10.167; 15.241; 14.536 90; 103.67; 90 | 2188.62 | Muller, V. U.; Vogler, S.; Dehnicke, K.; Fenske, D. Tetraphenylphosphonium- und natrium-15-krone-5-tetrachloro- cyclodithiadiazenorhenat Acta Crystallographica, Section C, 1990, 46, 1989-1992 |
9007852 | CIF | As Cu3 H3 O7 | P 1 21/c 1 | 7.257; 6.457; 12.378 90; 99.51; 90 | 572.043 | Eby, R. K.; Hawthorne, F. C. Clinoclase and the geometry of [5]-coordinate Cu2+ in minerals Acta Crystallographica, Section C, 1990, 46, 2291-2294 |
9007858 | CIF | C16 Cl Cr Fe N2 O3 | P 1 21/c 1 | 10.938; 12.487; 12.46 90; 111.43; 90 | 1584.17 | Wang, Y. P.; Hwu, J. M.; Wang, S. L. Structure of Cl(NO)2Cr(n5-C5H4)C(O)(n5-C5H4)Fe(n5-C5H5) Acta Crystallographica, Section C, 1990, 46, 2305-2308 |
9007865 | CIF | C64 Cl4 N6 Ru | P 1 21/c 1 | 15.627; 13.936; 17.319 90; 113.66; 90 | 3454.66 | Duff, C. M.; Heath, G. A.; Willis, A. C. Structural characterization of the RuIII benzonitrile complexes (Bu4N)[RuCl4(C6H5CN)2] and [RuCl3(C6H5CN)3] Acta Crystallographica, Section C, 1990, 46, 2320-2324 |
9007867 | CIF | C10 Cl N2 O2 S2 Tc | P 1 21/c 1 | 6.16; 26.727; 10.319 90; 96.89; 90 | 1686.63 | Faggiani, R.; Lock, C. J. L.; Epps, L. A.; Kramer, A. V.; Brune, H. D. {2,2'-dimethyl-1,1'-[(N,N'-2H2)-ethylenediamino]dipropane- 2-thiolato-N,N',S,S'}-oxotechnetium(V) chloride monodeuterate Acta Crystallographica, Section C, 1990, 46, 2324-2327 |
9007868 | CIF | C10 H2 N2 O9 Ru | P 1 21/c 1 | 8.415; 8.831; 17.633 90; 99.66; 90 | 1291.78 | Okamoto, K.; Hidaka, J.; Iida, I.; Higashino, K.; Kanamori, K. Structure of aqua(ethylenediaminetetraacetato)ruthenium(III) Acta Crystallographica, Section C, 1990, 46, 2327-2329 |
9007875 | CIF | C15 Cl2 N5 Pd S10 | P 1 21/c 1 | 11.546; 17.749; 13.724 90; 100.91; 90 | 2761.62 | Raper, E. S.; Britton, A. M.; Clegg, W. Structure of tetrakis(2,3-dihydro-1,3-thiazole-2-thione)palladium(II) dichloride 2,3-dihydro-1,3-thiazole-2-thione solvate Acta Crystallographica, Section C, 1990, 46, 2344-2346 |
9007895 | CIF | Fe H14 O11 S | P 1 21/c 1 | 13.9969; 6.4803; 11.0211 90; 105.596; 90 | 962.853 | Fronczek, F. R.; Collins, S. N.; Chan, J. Y. Refinement of ferrous sulfate heptahydrate (melanterite) with low-temperature CCD data Note: T = 120 K Locality: synthetic Acta Crystallographica, Section E, 2001, 57, i26-i27 |
9007897 | CIF | Ni3 O14 P4 Sr | P 1 21/c 1 | 7.4116; 7.6542; 9.4486 90; 112.194; 90 | 496.304 | Bolte, M. SrNi3(P2O7)2 Acta Crystallographica, Section E, 2001, 57, i30-i31 |
9007902 | CIF | H10 Na2 O8 S2 | P 1 21/c 1 | 5.947; 21.574; 7.526 90; 103.82; 90 | 937.637 | Prasad S M Rani A Rerefinement of sodium thiosulfate pentahydrate Acta Crystallographica, Section E, 2001, 57, i67-i69 |
9007917 | CIF | Co2 O7 P2 | P 1 21/c 1 | 7.0022; 8.3634; 9.0114 90; 113.6; 90 | 483.59 | Bali, B. E.; Bolte, M. Rerefinement of cobalt diphosphate against new intensity data Acta Crystallographica, Section E, 2002, 58, i32-i33 |
9007932 | CIF | Cl Cr K O3 | P 1 21/c 1 | 7.838; 7.493; 7.812 90; 91.4; 90 | 458.663 | Kolitsch, U. Redetermination of potassium chlorochromate, KCrO3Cl Acta Crystallographica, Section E, 2002, 58, i105-i107 |
9007966 | CIF | Cl2 Cu H16 O16 | P 1 21/c 1 | 6.2908; 12.4043; 9.2181 90; 106.146; 90 | 690.943 | Li, X. H.; Xia, F. Y.; Xiao, H. P.; Hu, M. L. Hexaaquacopper(II) diperchlorate dihydrate Acta Crystallographica, Section E, 2004, 60, i31-i32 |
9007988 | CIF | Cd O3 Si | P 1 21/c 1 | 6.9463; 7.2563; 15.0697 90; 94.791; 90 | 756.926 | Weil, M. Parawollastonite-type Cd3[Si3O9] Acta Crystallographica, Section E, 2005, 61, i102-i104 |
9008076 | CIF | Ca0.2 Fe1.12 Mg0.68 O6 Si2 | P 1 21/c 1 | 9.731; 8.953; 5.256 90; 71.45; 90 | 434.121 | Morimoto, N.; Appleman, D. E.; Evans, H. T. The crystal structures of clinoenstatite and pigeonite Zeitschrift fur Kristallographie, 1960, 114, 120-147 |
9008077 | CIF | Mg O3 Si | P 1 21/c 1 | 9.62; 8.825; 5.188 90; 71.67; 90 | 418.095 | Morimoto, N.; Appleman, D. E.; Evans, H. T. The crystal structures of clinoenstatite and pigeonite Zeitschrift fur Kristallographie, 1960, 114, 120-147 |
9008127 | CIF | As0.925 Cr Cu H O9 P0.075 Pb2 | P 1 21/c 1 | 8.101; 5.893; 17.547 90; 110; 90 | 787.161 | Cocco, G.; Fanfani, L.; Zanazzi, P. F. The crystal structure of fornacite Zeitschrift fur Kristallographie, 1967, 124, 385-397 |
9008162 | CIF | Eu I2 | P 1 21/c 1 | 7.64; 8.26; 7.88 90; 98; 90 | 492.439 | Barnighausen, H.; Beck, H.; Grueninger, H. W.; Rietschel, E. T.; Schultz, N. Neue AB2-strukturtypen mit siebenfach koordiniertem kation Zeitschrift fur Kristallographie, 1969, 128, 430-430 |
9008175 | CIF | H4 N2 O8 Zn | P 1 21/c 1 | 5.754; 5.978; 8.557 90; 91.03; 90 | 294.291 | Ribar, B.; Nowacki, W.; Sljukic, M.; Scavnicar, S.; Gabela, F. Die kristallstruktur von Zn(NO3)2*2H2O Zeitschrift fur Kristallographie, 1969, 129, 305-317 |
9008242 | CIF | Hg3 O8 P2 | P 1 21/c 1 | 9.737; 11.466; 6.406 90; 99.51; 90 | 705.365 | Arivillius, K.; Nilsson, B. A. The crystal structure of mercury(II)phosphate, Hg3(PO4)2 Zeitschrift fur Kristallographie, 1975, 141, 1-10 |
9008270 | CIF | Cu2.4 H18 O20 S2 Zn2.6 | P 1 21/c 1 | 5.589; 6.166; 23.751 90; 95.55; 90 | 814.665 | Mellini, M.; Merlino, S. Ktenasite, another mineral with 2[(Cu,Zn)2(OH)3O]- octahedral sheets Zeitschrift fur Kristallographie, 1978, 147, 129-140 |
9008287 | CIF | Cu2 S | P 1 21/c 1 | 15.246; 11.884; 13.494 90; 116.35; 90 | 2190.86 | Evans, H. T. The crystal structures of low chalocite and djurleite Zeitschrift fur Kristallographie, 1979, 150, 299-320 |
9008301 | CIF | As4 Cl6 O11 Pb8 | P 1 21/c 1 | 6.724; 11.2; 34.19 90; 85.2; 90 | 2565.78 | Klaska, R.; Gebert, W. Polytypie und struktur von gebhardit - Pb8OCl6(As2O5)2 Zeitschrift fur Kristallographie, 1982, 159, 75-76 |
9008302 | CIF | H5 Na O7 Si2 | P 1 21/c 1 | 7.3881; 18.094; 9.5234 90; 90.64; 90 | 1273.01 | Annehed, H.; Faelth, L.; Lincoln, F. J. Crystal structure of synthetic makatite Na2Si4O8(OH)2(H2O)4 Zeitschrift fur Kristallographie, 1982, 159, 203-210 |
9008303 | CIF | As8.55 S22 Sb4.45 Tl5 | P 1 21/c 1 | 17.441; 7.363; 32.052 90; 105.03; 90 | 3975.25 | Balic-Zunic T; Scavnicar, S.; Engel, P. The crystal structure of rebulite, Tl5Sb5As8S22 Zeitschrift fur Kristallographie, 1982, 160, 109-125 |
9008314 | CIF | As Be Ca H O5 | P 1 21/c 1 | 4.8818; 7.809; 10.127 90; 90.16; 90 | 386.06 | Hansen, S.; Falth, L.; Johnson, O. Bergslagite, a mineral with tetrahedral berylloarsenate sheet anions Note: anisoB's from ICSD Zeitschrift fur Kristallographie, 1984, 166, 73-80 |
9008420 | CIF | Ag2 Te | P 1 21/c 1 | 8.1616; 4.46651; 8.97335 90; 124.153; 90 | 270.7 | Schneider, J.; Schulz, H. X-ray powder diffraction of Ag2Te at temperatures up to 1123 K Locality: synthetic Note: T = 297 K Zeitschrift fur Kristallographie, 1993, 203, 1-15 |
9008949 | CIF | As Li | P 1 21/c 1 | 5.79; 5.24; 10.7 90; 117.4; 90 | 288.215 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 85-237 |
9008950 | CIF | Na Sb | P 1 21/c 1 | 6.8; 6.34; 12.48 90; 117.6; 90 | 476.811 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 85-237 |
9008951 | CIF | K Sb | P 1 21/c 1 | 7.18; 6.97; 13.4 90; 115.1; 90 | 607.272 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 85-237 |
9008962 | CIF | Ag O | P 1 21/c 1 | 5.852; 3.478; 5.495 90; 107.5; 90 | 106.665 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 85-237 |
9008992 | CIF | Cl I | P 1 21/c 1 | 12.6; 4.38; 11.9 90; 119.5; 90 | 571.595 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Iodine monochloride Crystal Structures, 1963, 1, 85-237 |
9009089 | CIF | O2 V | P 1 21/c 1 | 5.743; 4.517; 5.375 90; 122.6; 90 | 117.466 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
9009090 | CIF | Mo O2 | P 1 21/c 1 | 5.584; 4.842; 5.608 90; 120.983; 90 | 129.993 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
9009238 | CIF | O2 Si | P 1 21/c 1 | 7.66; 4.1; 5.03 90; 117.9; 90 | 139.61 | Haines, J.; Leger, J. M.; Gorelli, F.; Hanfland, M. Crystalline post-quartz phase in silica at high pressure Sample at ambient conditions Physical Review Letters, 2001, 87, 155503-155503 |
9009252 | CIF | As2 Cu Fe2 H10 O14 | P 1 21/c 1 | 10.189; 9.649; 5.598 90; 92.16; 90 | 549.969 | Keller, P.; Hess, H. Die kristallstruktur von arthurit, CuFe2[(H2O)4|(OH)2|(AsO4)2] Neues Jahrbuch fur Mineralogie, Abhandlungen, 1978, 133, 291-302 |
9009268 | CIF | Ag3 S3 Sb | P 1 21/c 1 | 6.84; 15.84; 6.24 90; 117.15; 90 | 601.583 | Kutoglu, A. Die struktur des pyrostilpnits (feuerblende) Ag3SbS3 Neues Jahrbuch fur Mineralogie, Monatshefte, 1968, 1968, 145-160 |
9009304 | CIF | Al2 Fe0.134 H2 Mg0.866 O10 P2 | P 1 21/c 1 | 7.144; 7.278; 7.228 90; 120.51; 90 | 323.778 | Giuseppetti, G.; Tadini, C. Lazulite, (Mg,Fe)Al2(OH)2(PO4)2: structure refinement and hydrogen bonding Neues Jahrbuch fur Mineralogie, Monatshefte, 1983, 1983, 410-416 |
9009405 | CIF | As1.8 Cu5 H4 O12 P0.2 | P 1 21/c 1 | 4.6; 5.757; 17.38 90; 91.87; 90 | 460.016 | Arlt, T.; Armbruster, T. Single-crystal X-ray structure refinement of cornwallite, Cu5(AsO4)2(OH)4: A comparison with its polymorph cornubite and the (PO4)-analogue pseudomalachite Locality: Clara mine, Oberwolfach, Black Forest, Germany Note: Biso for O2 and O4 switched to match calculated values Neues Jahrbuch fur Mineralogie, Monatshefte, 1999, 1999, 468-480 |
9009454 | CIF | Al2 Fe0.02 H44 Mg0.28 Mn0.64 O38 S4 Zn0.06 | P 1 21/c 1 | 6.198; 24.347; 21.266 90; 100.28; 90 | 3157.58 | Menchetti, S.; Sabelli, C. The halotrichite group: The crystal structure of apjohnite Mineralogical Magazine, 1976, 40, 599-608 |
9009474 | CIF | As5 S8 Tl | P 1 21/c 1 | 15.647; 8.038; 10.75 90; 91.27; 90 | 1351.7 | Pasava, J.; Pertlik, F.; Stumpfl, E. F.; Zemann, J. Bernardite, a new thallium arsenic sulphosalt from Allchar, Macedonia, with a determination of the crystal structure Mineralogical Magazine, 1989, 53, 531-538 |
9009521 | CIF | Ca Cu H8 O14 P2 U | P 1 21/c 1 | 12.784; 6.996; 13.007 90; 91.92; 90 | 1162.65 | Kolitsch, U.; Giester, G. Revision of the crystal structure of ulrichite, CaCu2+(UO2)(PO4)2*4(H2O) Mineralogical Magazine, 2001, 65, 717-724 |
9009620 | CIF | Ca Cu H2 O5 Si | P 1 21/c 1 | 5.03; 16.135; 5.343 90; 102.96; 90 | 422.587 | Hawthorne, F. C. The crystal structure of stringhamite Tschermaks Mineralogische und Petrographische Mitteilungen, 1985, 34, 15-24 |
9009639 | CIF | C K Li O3 | P 1 21/c 1 | 7.22284; 7.07673; 7.59397 90; 127.421; 90 | 308.273 | Idemoto, Y.; Richardson, J. W.; Koura, N.; Kohara, S.; Loong, C. K. Crystal structure of (LixK1-x)2CO3 (x = 0,0.43,0.5,0.62,1) by neutron powder diffraction analysis Sample: contains only 7Li Journal of Physics and Chemistry of Solids, 1998, 59, 363-376 |
9009640 | CIF | C K Li O3 | P 1 21/c 1 | 7.22806; 7.08181; 7.59999 90; 127.418; 90 | 308.974 | Idemoto, Y.; Richardson, J. W.; Koura, N.; Kohara, S.; Loong, C. K. Crystal structure of (LixK1-x)2CO3 (x = 0,0.43,0.5,0.62,1) by neutron powder diffraction analysis Sample: contains natural Li Journal of Physics and Chemistry of Solids, 1998, 59, 363-376 |
9009644 | CIF | C K2 O3 | P 1 21/c 1 | 5.63961; 9.83912; 6.87407 90; 98.703; 90 | 377.042 | Idemoto, Y.; Richardson, J. W.; Koura, N.; Kohara, S.; Loong, C. K. Crystal structure of (LixK1-x)2CO3 (x = 0,0.43,0.5,0.62,1) by neutron powder diffraction analysis Sample: neutron powder diffraction refinement Journal of Physics and Chemistry of Solids, 1998, 59, 363-376 |
9009645 | CIF | C K2 O3 | P 1 21/c 1 | 5.64; 9.8; 6.88 90; 98.8; 90 | 375.795 | Idemoto, Y.; Richardson, J. W.; Koura, N.; Kohara, S.; Loong, C. K. Crystal structure of (LixK1-x)2CO3 (x = 0,0.43,0.5,0.62,1) by neutron powder diffraction analysis Sample: single crystal X-ray diffraction refinement Note: y(K1) changed to match reported bond lengths Journal of Physics and Chemistry of Solids, 1998, 59, 363-376 |
9009646 | CIF | C K1.14 Li0.86 O3 | P 1 21/c 1 | 7.2232; 7.0769; 7.5951 90; 127.422; 90 | 308.337 | Idemoto, Y.; Richardson, J. W.; Koura, N.; Kohara, S.; Loong, C. K. Crystal structure of (LixK1-x)2CO3 (x = 0,0.43,0.5,0.62,1) by neutron powder diffraction analysis Note: occupancies invented to match formula Journal of Physics and Chemistry of Solids, 1998, 59, 363-376 |
9009717 | CIF | Ag2 Hg S2 | P 1 21/c 1 | 4.0394; 8.005; 6.5812 90; 107.12; 90 | 203.376 | Guillou, J. J.; Monthel, J.; Picot, P.; Pillard, F.; Protas, J.; Samama, J. C. L'imiterite, Ag2HgS2 nouvelle espece minerale; proprietes et structure cristalline Locality: Tinerhir, Boulmane, Morocco Bulletin de Mineralogie, 1985, 108, 457-464 |
9009722 | CIF | Nd O22 P2 U3 | P 1 21/c 1 | 9.298; 15.605; 13.668 90; 112.77; 90 | 1828.61 | Piret, P.; Deliens, M.; Piret-Meunier J La francoisite-(Nd), nouveau phosphate d'uranyle et de terres rares; proprietes et structure cristalline Bulletin de Mineralogie, 1988, 111, 443-449 |
9009746 | CIF | Mg2 O7 V2 | P 1 21/c 1 | 6.599; 8.406; 9.472 90; 100.608; 90 | 516.443 | Nielsen, U. G.; Jakobsen, H. J.; Skibsted, J.; Norby, P. Crystal structure of alpha-Mg2V2O7 from synchrotron X-ray powder diffraction and characterization by 51V MAS NMR spectroscopy Note: z-coordinate of V1 changed as directed by the author, Aug 2005. Dalton Transactions, 2001, 2001, 3214-3218 |
9009752 | CIF | Ce O4 Ta | P 1 21/c 1 | 7.6161; 5.5254; 7.7588 90; 100.87; 90 | 320.648 | Santoro, A.; Marezio, M.; Roth, R. S.; Minor, D. Neutron powder diffraction study of the structures of CeTaO4, CeNbO4, and NdTaO4 Journal of Solid State Chemistry, 1980, 35, 167-175 |
9009774 | CIF | H Mn O2 | P 1 21/c 1 | 5.304; 5.277; 5.304 90; 114.38; 90 | 135.217 | Kohler, T.; Armbruster, T.; Libowitzky, E. Hydrogen bonding and Jahn-Teller distortion in groutite, alpha-MnOOH, and manganite, gamma-MnOOH, and their relations to the manganese dioxides ramsdellite and pyrolusite Note: Uiso corrected Journal of Solid State Chemistry, 1997, 133, 486-500 |
9009800 | CIF | Ca H2 I2 O7 | P 1 21/c 1 | 8.5055; 10.0221; 7.5052 90; 95.31; 90 | 637.02 | Alici, E.; Schmidt, T.; Lutz, H. D. Zur kenntnis des calciumbromats und -iodats, kristallstruktur, rontgenographische, IR- und Raman-spektroskopische und thermo-analytische untersuchungen Zeitschrift fur Anorganische und Allgemeine Chemie, 1992, 608, 135-144 |
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 |
9009860 | CIF | Al2 Fe H18 O18 P2 | P 1 21/c 1 | 10.22; 9.56; 6.94 90; 97.9; 90 | 671.625 | Baur, W. H.; Rao, B. R. The crystal structure of metavauxite Die Naturwissenschaften, 1967, 54, 561-561 |
9009868 | CIF | As Bi2 H O6 | P 1 21/c 1 | 7; 7.43; 10.831 90; 107.08; 90 | 538.475 | Mereiter, K.; Preisinger, A. Kristallstrukturdaten der wismutminerale atelestit, mixit und pucherit Anzeiger der Osterreichische Akademie der Wissenschaften, 1986, 123, 79-81 |
9009891 | CIF | S8 | P 1 21/c 1 | 10.926; 10.855; 10.79 90; 95.92; 90 | 1272.89 | Templeton, L. K.; Templeton, D. H.; Zalkin, A. Crystal structure of monoclinic sulfur Note: this is known as the beta phase of sulfur Inorganic Chemistry, 1976, 15, 1999-2001 |
9009907 | CIF | As2 Ir | P 1 21/c 1 | 6.0549; 6.0717; 6.1587 90; 113.197; 90 | 208.111 | Kjekshus, A. On the properties of binary compounds with the CoSb2 type crystal structure Acta Chemica Scandinavica, 1971, 25, 411-422 |
9009908 | CIF | As2 Co | P 1 21/c 1 | 5.9106; 5.868; 5.9587 90; 116.432; 90 | 185.064 | Kjekshus, A. On the properties of binary compounds with the CoSb2 type crystal structure Acta Chemica Scandinavica, 1971, 25, 411-422 |
9009962 | CIF | Al F4 H3 O2 Sr | P 1 21/c 1 | 5.02; 10.62; 8.73 90; 102.7; 90 | 454.031 | Pudovkina, Z. V.; Chernitsova, N. M.; Pyatenko Yu, A. Crystal structure refinement of tikhonenkovite Sr2[Al2F8(OH)2]*2H2O Journal of Structural Chemistry, 1973, 14, 445-448 |
9009974 | CIF | Al1.98 Fe0.99 H44 Mg0.02 Mn0.01 O38 S4 | P 1 21/c 1 | 6.1954; 24.262; 21.262 90; 100.3; 90 | 3144.45 | Lovas, G. A. Structural study of halotrichite from Recsk (Matra Mts., N-Hungary) Acta Geologica Hungarica, 1986, 29, 389-398 |
9010290 | CIF | Al2 Ca0.2 O8 Si2 Sr0.8 | P 1 21/c 1 | 8.116; 12.41; 13.728 90; 114.19; 90 | 1261.27 | Benna, P.; Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Lundegaard, L. F.; Bruno, E. The high-pressure structural configurations of Ca0.2Sr0.8Al2Si2O8 feldspar: The I-1-I2/c and I2/c-P2_1/c phase transitions Sample: P = 7.4 GPa American Mineralogist, 2007, 92, 1190-1199 |
9010400 | CIF | As2 Cu1.87 H12 Mg3.13 O16 | P 1 21/c 1 | 5.459; 16.808; 6.917 90; 100.44; 90 | 624.162 | Kyono, A. Compositional variability and crystal structural features of guanacoite American Mineralogist, 2008, 93, 501-507 |
9010467 | CIF | B0.8 Be1.08 Ca0.8 Ce0.24 Dy0.04 Er0.02 Eu2 Fe0.71 Gd0.04 La0.06 Li0.35 Mg0.02 Mn0.03 Nd0.16 O10 Pr0.04 Si2 Sm0.04 Th0.14 U0.02 Y0.38 Yb0.02 | P 1 21/c 1 | 4.7708; 7.6229; 9.8975 90; 90.017; 90 | 359.946 | Camara, F.; Oberti, R.; Ottolini, L.; Ventura, G. D.; Bellatreccia, F. The crystal chemistry of Li in gadolinite American Mineralogist, 2008, 93, 996-1004 |
9010498 | CIF | Al2 Ca H12.64 O12.77 Si2 | P 1 21/c 1 | 10.0155; 10.6051; 9.8277 90; 92.409; 90 | 1042.93 | Ori, S.; Quartieri, S.; Vezzalini, G.; Dmitriev, V. Pressure-induced over-hydration and water ordering in gismondine: a synchrotron powder diffraction study Note: ambient pressure American Mineralogist, 2008, 93, 1393-1403 |
9010499 | CIF | Al2 Ca H12.64 O13 Si2 | P 1 21/c 1 | 9.8917; 10.5948; 9.7482 90; 92.2; 90 | 1020.86 | Ori, S.; Quartieri, S.; Vezzalini, G.; Dmitriev, V. Pressure-induced over-hydration and water ordering in gismondine: a synchrotron powder diffraction study Note: pressure = 1.6 GPa American Mineralogist, 2008, 93, 1393-1403 |
9010500 | CIF | Al2 Ca H10 O13 Si2 | P 1 21/c 1 | 9.7975; 10.626; 9.6977 90; 91.225; 90 | 1009.38 | Ori, S.; Quartieri, S.; Vezzalini, G.; Dmitriev, V. Pressure-induced over-hydration and water ordering in gismondine: a synchrotron powder diffraction study Note: pressure = 1.9 GPa American Mineralogist, 2008, 93, 1393-1403 |
9010501 | CIF | Al2 Ca H12.64 O12.95 Si2 | P 1 21/c 1 | 10.0264; 10.6094; 9.8377 90; 92.369; 90 | 1045.58 | Ori, S.; Quartieri, S.; Vezzalini, G.; Dmitriev, V. Pressure-induced over-hydration and water ordering in gismondine: a synchrotron powder diffraction study Note: pressure = 0 after decompression American Mineralogist, 2008, 93, 1393-1403 |
9010596 | CIF | As2 Ca1.9 Fe0.01 H4 Mg0.1 Mn0.88 O10 Pb0.1 | P 1 21/c 1 | 5.877; 12.957; 5.675 90; 108; 90 | 410.991 | Herwig, S.; Hawthorne, F. C. The topology of hydrogen bonding in brandtite, collinsite and fairfieldite The Canadian Mineralogist, 2006, 44, 1181-1196 |
9010624 | CIF | D13.16 Fe H0.84 O11 S | P 1 21/c 1 | 14.0774; 6.5039; 11.0506 90; 105.604; 90 | 974.481 | Anderson, J. L.; Peterson, R. C.; Swainson, I. P. The atomic structure and hydrogen bonding of deuterated melanterite, FeSO4*7D2O Locality: synthetic The Canadian Mineralogist, 2007, 45, 457-469 |
9010630 | CIF | Cl2 Cu5 O8 Se2 | P 1 21/c 1 | 5.3982; 8.0543; 11.1277 90; 99.258; 90 | 477.516 | Krivovichev, S. V.; Filatov, S. K.; Burns, P. C.; Vergasova, L. P. The crystal structure of parageorgbokiite, B-Cu5O2(SeO3)2Cl2 The Canadian Mineralogist, 2007, 45, 929-934 |
9010674 | CIF | Cl5 Pb2 Tl | P 1 21/c 1 | 8.9477; 7.9218; 12.4955 90; 90.092; 90 | 885.704 | Campostrini, I.; Demartin, F.; Gramaccioli, C. M.; Orlandi, P. Hephaistosite, TlPb2Cl5, a new thallium mineral series from La Fossa Crater, Vulcano, Aeolian Islands, Italy Location: La Fossa Crater, Vulcano, Aeolian Islands, Italy The Canadian Mineralogist, 2008, 46, 701-708 |
9010722 | CIF | B2 Ca Mg O5 | P 1 21/c 1 | 12.329; 11.146; 5.519 90; 101.62; 90 | 742.872 | Callegari, A.; Mazzi, F.; Tadini, C. Modular aspects of the crystal structures of kurchatovite and clinokurchatovite Locality: Sayak, Kazackhstan European Journal of Mineralogy, 2003, 15, 277-282 |
9010744 | CIF | As2 Ca2 Co0.1 H4 Mg0.9 O10 | P 1 21/c 1 | 5.806; 12.923; 5.628 90; 107.49; 90 | 402.752 | Kolitsch, U.; Fleck, M. Third update on compounds with krohnkite-type chains: the crystal structure of wendwilsonite [Ca2Mg(AsO4)2*2H2O] and the new triclinic structure types of synthetic AgSc(CrO4)2*2H2O and M2Cu(Cr2O7)2*2H2O (M = Rb, Cs) Locality: Schneeberg, Saxony, Germany European Journal of Mineralogy, 2006, 18, 471-482 |
9010774 | CIF | As2 Cu2.582 H12 Mg2.418 O16 | P 1 21/c 1 | 5.475; 16.865; 6.915 90; 99.8; 90 | 629.185 | Witzke, T.; Kolitsch, U.; Krause, W.; Wiechowski, A.; Medenbach, O.; Kampf, A. R.; Steele, I. M.; Favreau, G. Guanacoite, Cu2Mg2(Mg0.5Cu0.5)(OH)4(H2O)4(AsO4)2, a new arsenate mineral species from the El Guanaco Mine, near Taltal, Chile: Description and crystal structure Locality: El Guanaco Mine, Taltal, Chile European Journal of Mineralogy, 2006, 18, 813-821 |
9010783 | CIF | Ca Cl Cu5 H10 Na O20.56 P4 | P 1 21/c 1 | 9.695; 9.673; 19.739 90; 102.61; 90 | 1806.47 | Giester, G.; Kolitsch, U.; Leverett, P.; Turner, P.; Williams, P. A. The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite Locality: Lake Boga, Victoria, Australia Note: This is a polymorph or perhaps polytype of sampleite European Journal of Mineralogy, 2007, 19, 75-93 |
9010802 | CIF | Fe0.732 Mg2.268 O8 P2 | P 1 21/c 1 | 5.9305; 4.7583; 10.2566 90; 90.663; 90 | 289.413 | Grew, E. S.; Armbruster, T.; Medenbach, O.; Yates, M. G.; Carson, C. J. Chopinite, [(Mg,Fe)3_](PO4)2, a new mineral isostructural with sarcopside, from a fluorapatite segregation in granulite-facies paragneiss, Larsemann Hills, Prydz Bay, East Antarctica Locality: Brattnevet, Larsemann Hills, Prydz Bay, East Antarctica European Journal of Mineralogy, 2007, 19, 229-245 |
9010811 | CIF | Ag1.5 Pb4.43 S14 Sb6.07 | P 1 21/c 1 | 4.1035; 27.3144; 22.9366 90; 90.359; 90 | 2570.79 | Laufek, F.; Pazout, R.; Makovicky, E. Crystal structure of owyheeite, Ag1.5Pb4.43Sb6.07S14: refinement from powder synchrotron X-ray diffraction European Journal of Mineralogy, 2007, 19, 557-566 |
9010982 | CIF | O3 S | P 1 21/c 1 | 6.2; 4.06; 9.31 90; 109.83; 90 | 220.455 | Westrik, R.; MacGillavry, C. H. The crystal structure of the asbestos-like form of sulphur trioxide Acta Crystallographica, 1954, 7, 764-767 |
9011047 | CIF | As13 Pb9 S28 | P 1 21/c 1 | 8.43; 70.9; 7.91 90; 90.25; 90 | 4727.66 | Le Bihan, M. T. Structure de la rathite II. Comparaison entre les differentes structures connues de sulfures d'arsenic et de plomb Acta Crystallographica, 1961, 14, 1211-1212 |
9011048 | CIF | C H Na O3 | P 1 21/c 1 | 3.51; 9.71; 8.05 90; 111.85; 90 | 254.651 | Sass, R. L.; Scheuerman, R. F. The crystal structure of sodium bicarbonate Acta Crystallographica, 1962, 15, 77-81 |
9011101 | CIF | B5 H4 N O10 | P 1 21/c 1 | 9.47; 7.63; 11.65 90; 97.08; 90 | 835.365 | Merlino, S.; Sartori, F. The crystal structure of lardellite, NH4B5O7(OH)2*H2O Acta Crystallographica, Section B, 1969, 25, 2264-2270 |
9011121 | CIF | H9 N2 O4 P | P 1 21/c 1 | 11.043; 6.7; 8.031 90; 113.42; 90 | 545.246 | Khan, A. A.; Roux, J. P.; James, W. J. The crystal structure of diammonium hydrogen phosphate, (NH4)2HPO4 Acta Crystallographica, Section B, 1972, 28, 2065-2069 |
9011140 | CIF | Cu O5 Te2 | P 1 21/c 1 | 6.871; 9.322; 7.602 90; 109.08; 90 | 460.169 | Hanke, K.; Kupcik, V.; Lindqvist, O. The crystal structure of CuTe2O5 Acta Crystallographica, Section B, 1973, 29, 963-970 |
9011142 | CIF | Cu5 O10 V2 | P 1 21/c 1 | 8.393; 6.0652; 16.156 90; 108.09; 90 | 781.772 | Shannon, R. D.; Calvo, C. Crystal structure of Cu5V2O10 Acta Crystallographica, Section B, 1973, 29, 1338-1345 |
9011143 | CIF | As Hg3 O4 | P 1 21/c 1 | 8.73; 5.08; 15.64 90; 128.4; 90 | 543.577 | Kamenar, B.; Kaitner, B. The crystal structure of mercury(I) orthoarsenate Acta Crystallographica, Section B, 1973, 29, 1666-1669 |
9011148 | CIF | Cl H4 Na O2 | P 1 21/c 1 | 6.3313; 10.1178; 6.5029 90; 114.407; 90 | 379.341 | Klewe, B.; Pedersen, B. The crystal structure of sodium chloride dihydrate Acta Crystallographica, Section B, 1974, 30, 2363-2371 |
9011167 | CIF | O12 S3 Sb2 | P 1 21/c 1 | 13.12; 4.75; 17.55 90; 126.3; 90 | 881.457 | Mercier, R.; Douglade, J.; Bernard, J. Structure cristalline de Sb2O3*3SO3 Acta Crystallographica, Section B, 1976, 32, 2787-2791 |
9011207 | CIF | H12 Mg N2 O12 | P 1 21/c 1 | 6.194; 12.707; 6.6 90; 92.99; 90 | 518.76 | Braibanti, A.; Tiripicchio, A.; Lanfredi, A. M. M.; Bigoli, F. The crystal structures of nitrates of divalent hexaquocations. II. Hexaquomagnesium nitrate Note: z(Wat2) corrected Acta Crystallographica, Section B, 1979, 35, 354-361 |
9011209 | CIF | H10 O10 S V | P 1 21/c 1 | 6.976; 9.716; 12.902 90; 110.9; 90 | 816.945 | Tachez, M.; Theobald, F. R.; Watson, K. J.; Mercier, R. Redetermination de la structure du sulfate de vanadyle pentahydrate VOSO4*5H2O Locality: synthetic Note: anisoB's from ICSD Acta Crystallographica, Section B, 1979, 35, 1545-1550 |
9011221 | CIF | C2 Na2 O4 | P 1 21/c 1 | 3.449; 5.243; 10.375 90; 92.66; 90 | 187.41 | Reed, D. A.; Olmstead, M. M. Sodium oxalate structure refinement Sample: T = 140 K Acta Crystallographica, Section B, 1981, 37, 938-939 |
9011230 | CIF | As2 O12 S3 | P 1 21/c 1 | 9.389; 5.255; 19.355 90; 91.88; 90 | 954.446 | Douglade, J.; Mercier, R. Structure cristalline et covalence des liaisons dans le sulfate d'arsenic(III), As2(SO4)3 Note: anisoB's from ICSD Acta Crystallographica, Section B, 1982, 38, 720-723 |
9011238 | CIF | Bi2 H2 O7 S | P 1 21/c 1 | 7.692; 13.87; 5.688 90; 109.01; 90 | 573.745 | Golic, L.; Graunar, M.; Lazarini, F. catena-Di-mu-hydroxo-mu3-oxo-dibismuth(III) sulfate Acta Crystallographica, Section B, 1982, 38, 2881-2883 |
9011249 | CIF | As2 O9 S2 | P 1 21/c 1 | 6.65; 6.671; 16.612 90; 94.34; 90 | 734.831 | Marsh, R. E.; Herbstein, F. H. More space-group changes Acta Crystallographica, Section B: Structural Science, 1988, 44, 77-88 |
9011318 | CIF Paper | Ag14.691 Cu1.309 S8.37 Sb2 Se2.63 | P 1 21/c 1 | 13.1426; 7.5879; 23.729 90; 90; 90 | 2366.37 | Evain, M.; Bindi, L.; Menchetti, S. Structure and phase transition of the Se-rich variety of antimonpearceite, [(Ag,Cu)~6~(Sb,As)~2~(S,Se)~7~][Ag~9~Cu(S,Se)~2~Se~2~] Acta Crystallographica Section B, 2006, 62, 768-774 |
9011381 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5394; 8.5756; 5.2508 90; 110.124; 90 | 403.324 | Sato, A.; Osawa, T.; Ohashi, H. Low-temperature form of LiGaSi2O6 Sample: T = 273 K Note: anisoU's from ICSD Acta Crystallographica, Section C, 1995, 51, 1959-1960 |
9011481 | CIF | H Mg2 O5 P | P 1 21/c 1 | 9.656; 12.859; 12.069 90; 108.49; 90 | 1421.21 | Raade, G.; Romming, C. The crystal structure of beta-Mg2PO4OH, a synthetic hydroxyl analogue of wagnerite Zeitschrift fur Kristallographie, 1986, 177, 15-26 |
9011484 | CIF | H20 Mg O22 P2 U2 | P 1 21/c 1 | 6.951; 19.947; 9.896 90; 135.17; 90 | 967.336 | Miller, S. A.; Taylor, J. C. The crystal structure of saleeite, Mg[UO2PO4]2*10H2O Zeitschrift fur Kristallographie, 1986, 177, 247-253 |
9011514 | CIF | Ca Mg Na2 O8 P2 | P 1 21/c 1 | 9.12; 5.198; 13.37 90; 90.78; 90 | 633.756 | Alkemper, J.; Fuess, H. The crystal structures of NaMgPO~4~, Na~2~CaMg(PO~4~)~2~ and Na~18~Ca~13~Mg~5~(PO~4~)~18~: new examples for glaserite related structures Note: known as the alpha polymorph of Na~2~CaMg(PO~4~)~2~ Zeitschrift f"ur Kristallographie, 1998, 213, 282-287 |
9011518 | CIF | Cl2 Cu5 O8 Se2 | P 1 21/c 1 | 6.03; 13.744; 5.562 90; 95.75; 90 | 458.639 | Krivovichev, S. V.; Shuvalov, R. R.; Semenova, T. F.; Filatov, S. K. Crystal chemistry of inorganic compounds based on chains of oxocentered tetrahedra. III. Crystal structure of georgbokiite, Cu5O2(SeO3)2Cl2 Zeitschrift fur Kristallographie, 1999, 214, 135-138 |
9011524 | CIF | Ag0.474 As4.522 Pb2.739 S10 Sb0.265 | P 1 21/c 1 | 8.496; 7.969; 25.122 90; 100.704; 90 | 1671.28 | Berlepsch, P.; Armbruster, T.; Topa, D. Structural and chemical variations in rathite, Pb8Pb4-x(Tl2As2)x(Ag2As2)As16S40: modulations of a parent structure Locality: Valais, Switzerland Zeitschrift fur Kristallographie, 2002, 217, 581-590 |
9011760 | CIF | As0.03 Bi2 H O6 V0.97 | P 1 21/c 1 | 6.971; 7.535; 10.881 90; 107; 90 | 546.567 | Krause, W.; Bernhardt, H. J.; Blass, G.; Effenberger, H.; Graf, H. W. Hechtsbergite, Bi2O(OH)(VO4), a new mineral from the Black Forest, Germany Neues Jahrbuch fur Mineralogie, Monatshefte, 1997, 1997, 271-287 |
9011801 | CIF | As2 Fe2 H10 O14 Zn | P 1 21/c 1 | 10.237; 9.662; 5.562 90; 94.36; 90 | 548.545 | Hughes, J. M.; Bloodaxe, E. S.; Kobel, K. D.; Drexler, J. W. The atomic arrangement of ojuelaite, ZnFe(3+)2(AsO4)2(OH)2*4H2O Mineralogical Magazine, 1996, 60, 519-521 |
9011806 | CIF | As Cl4 H O4 Pb4 | P 1 21/c 1 | 13.765; 7.896; 10.804 90; 102.57; 90 | 1146.12 | Pasero, M.; Vacchiano, D. Crystal structure and revision of the chemical formula of georgiadesite, Pb4(AsO3)Cl4(OH) Mineralogical Magazine, 2000, 64, 879-884 |
9011888 | CIF | H2 Mn O6 Si Zn2 | P 1 21/c 1 | 11.71; 5.34; 8.13 90; 95.58; 90 | 505.971 | Solov'eva, L. P.; Belov, N. V. Crystal structure of hodgkinsonite Zn2Mn[SiO4](OH)2 Soviet Physics Doklady, 1963, 8, 867-870 |
9011935 | CIF | C H12 Ca2 Mg3 Na O21 P3 | P 1 21/c 1 | 6.522; 12.25; 21.56 90; 89.48; 90 | 1722.45 | Sokolova, E. V.; Yegorov-Tismenko Y K Crystal structure of girvasite Doklady Akademii Nauk SSSR, 1990, 331, 1372-1376 |
9011947 | CIF | Fe H3 O5 Te | P 1 21/c 1 | 10.984; 10.268; 7.917 90; 108.49; 90 | 846.816 | Donnay, G.; Stewart, J. M.; Preston, H. The crystal structure of sonoraite, Fe3+Te4+O3(OH)*H2O Tschermaks Mineralogische und Petrographische Mitteilungen, 1970, 14, 27-44 |
9011954 | CIF | Fe0.875 H8 Mn2 O12 P2 | P 1 21/c 1 | 8.496; 13.173; 17.214 90; 96.65; 90 | 1913.59 | Fanfani, L.; Zanazzi, P. F. Switzerite: its chemical formula and crystal structure Note: could not reproduce Wat18 bond lengths Note: IMA official name of this phase changed from switzerite Tschermaks Mineralogische und Petrographische Mitteilungen, 1979, 26, 255-269 |
9012075 | CIF | C6 H6 Fe K3 O15 | P 1 21/c 1 | 7.66; 19.87; 10.27 90; 105.1; 90 | 1509.17 | Herpin, P. Structure cristalline des trioxalates complexes de potassium II. Structure du ferrotrioxalate de potassium racemique et comparaison avec les trioxalates complexes actifs Locality: synthetic Note: C3'(y) changed to 0.259, but still unable to reproduce reported bond distances Bulletin de la Societe Francaise de Mineralogie et de Cristallographie, 1958, 81, 245-256 |
9012077 | CIF | As2 Co | P 1 21/c 1 | 5.972; 5.86; 5.917 90; 116.685; 90 | 185.016 | Darmon, R.; Wintenberger, M. Structure cristalline de CoAs2 Note: coordinates transformed from B2_1/d to P2_1/c Bulletin de la Societe Francaise de Mineralogie et de Cristallographie, 1966, 89, 213-215 |
9012088 | CIF | H10 O22 Pb2 U5 | P 1 21/c 1 | 10.704; 6.96; 14.533 90; 116.81; 90 | 966.323 | Piret, P.; Deliens, M.; Piret-Meunier J; Germain, G. La sayrite, Pb2[(UO2)5O6(OH)2]*4H2O, nouveau mineral; proprietes et structure cristalline Locality: Shinkolobwe, Shaba, Zaire Bulletin de Mineralogie, 1983, 106, 299-304 |
9012104 | CIF | Se8 | P 1 21/c 1 | 15.018; 14.713; 8.789 90; 93.61; 90 | 1938.16 | Foss, O.; Janickis, V. Crystal structure of gamma-monoclinic selenium Note: structure known as gamma phase Note: gamma-monoclinic selenium is allotrope of cyclo-octaselenium Dalton Transactions, 1980, 1980, 624-627 |
9012201 | CIF | Cs H6 In2 O14 P3 | P 1 21/c 1 | 6.58; 18.092; 10.18 90; 97.92; 90 | 1200.32 | Dhingra, S. S.; Haushalter, R. C. Synthesis and crystal structure of the octahedral-tetrahedral framework indium phosphate Cs[In2(PO4)(HPO4)2(H2O)2] Journal of Solid State Chemistry, 1994, 112, 96-99 |
9012205 | CIF | Ca3 O9 Si2 Zr | P 1 21/c 1 | 7.3603; 10.1766; 10.4514 90; 90.875; 90 | 782.748 | Plaisier, J. R.; Jansen, J.; de Graaff, R. A. G.; Ijdo, D. J. W. Structure determination of Ca3HfSi2O9 and Ca3ZrSi2O9 from powder diffraction Journal of Solid State Chemistry, 1995, 115, 464-468 |
9012206 | CIF | Ca3 Hf O9 Si2 | P 1 21/c 1 | 7.3517; 10.1489; 10.4319 90; 91.084; 90 | 778.202 | Plaisier, J. R.; Jansen, J.; de Graaff, R. A. G.; Ijdo, D. J. W. Structure determination of Ca3HfSi2O9 and Ca3ZrSi2O9 from powder diffraction Journal of Solid State Chemistry, 1995, 115, 464-468 |
9012352 | CIF | Cl8 Cu5 H8 K2 O6 | P 1 21/c 1 | 11.6424; 6.5639; 11.771 90; 91.09; 90 | 899.372 | Kahlenberg, V. On the crystal structure of K2Cu5Cl8(OH)4*2H2O Zeitschrift fur Anorganische und Allgemeine Chemie, 2004, 630, 900-903 |
9012366 | CIF | Co D14 O11 S | P 1 21/c 1 | 14.048; 6.4941; 10.925 90; 105.232; 90 | 961.665 | Kellersohn, T.; Delaplane, R. G.; Olovsson, I. Disorder of a trigonally planar coordinated water molecule in cobalt sulfate heptahydrate, CoSO4*7D2O Zeitschrift fur Naturforschung B, 1991, 46, 1635-1640 |
9012387 | CIF | Pt5 Se4 | P 1 21/c 1 | 6.577; 4.61; 11.122 90; 101.59; 90 | 330.343 | Matkovic, P.; Schubert, K. Kristallstruktur von Pt5Se4 Journal of the Less-Common Metals, 1977, 55, 185-190 |
9012388 | CIF | Pd9 Te4 | P 1 21/c 1 | 7.458; 13.938; 8.839 90; 91.97; 90 | 918.267 | Matkovic, P.; Schubert, K. Kristallstruktur von Pd9Te4 Journal of the Less-Common Metals, 1978, 58, P39-P46 |
9012416 | CIF | Al2 Ca H8.606 O12.303 Si2 | P 1 21/c 1 | 10.011; 10.614; 9.853 90; 93.11; 90 | 1045.41 | Artioli, G.; Rinaldi, R.; Kvick, A.; Smith, J. V. Neutron diffraction structure refinement of the zeolite gismondine at 15 K Sample: T = 15 K Zeolites, 1986, 6, 361-366 |
9012423 | CIF | As2 Ca2 H4 Mn O10 | P 1 21/c 1 | 5.65; 12.8; 5.65 90; 80.5; 90 | 403.004 | Dahlman, B. The crystal structures of krohnkite, CuNa2(SO4)2*2H2O and brandtite, MnCa2(AsO4)2*2H2O Locality: Harstigen mine, Sweden Arkiv for Mineralogi och Geologi, 1952, 1, 339-366 |
9012424 | CIF | Cu H4 Na2 O10 S2 | P 1 21/c 1 | 5.78; 12.58; 5.48 90; 71.5; 90 | 377.873 | Dahlman, B. The crystal structures of krohnkite, CuNa2(SO4)2*2H2O and brandtite, MnCa2(AsO4)2*2H2O Locality: Chuquicamata, Chile Arkiv for Mineralogi och Geologi, 1952, 1, 339-366 |
9012546 | CIF | Bi2 O3 | P 1 21/c 1 | 5.8486; 8.1661; 7.5097 90; 113; 90 | 330.153 | Malmros, G. The crystal structure of alpha-Bi2O3 Acta Chemica Scandinavica, 1970, 24, 384-396 |
9012611 | CIF | C2 H4 Mg O6 | P 1 21/c 1 | 8.69; 7.18; 9.39 90; 97.6; 90 | 580.735 | Osaki, K.; Nakai, Y.; Watanabe, T. The crystal structure of magnesium formate dihydrate and manganous formate dihydrate Journal of the Physical Society of Japan, 1964, 19, 717-723 |
9012612 | CIF | C2 H4 Mn O6 | P 1 21/c 1 | 8.86; 7.29; 9.6 90; 97.7; 90 | 614.467 | Osaki, K.; Nakai, Y.; Watanabe, T. The crystal structure of magnesium formate dihydrate and manganous formate dihydrate Journal of the Physical Society of Japan, 1964, 19, 717-723 |
9012640 | CIF | Al As Cu O5 | P 1 21/c 1 | 7.335; 10.255; 5.599 90; 99.79; 90 | 415.026 | Krivovichev, S. V.; Molchanov, A. V.; Filatov, S. K. Crystal structure of urusovite Cu(AlAsO5): a new type of an aluminoarsenate tetrahedral polyanion Crystallography Reports, 2000, 45, 723-727 |
9012716 | CIF | F Mg2 O4 P | P 1 21/c 1 | 9.644; 12.679; 11.957 90; 108.3; 90 | 1388.11 | Coda, A.; Giuseppetti, G.; Tadini, C.; Carobbi, S. G. The crystal structure of wagnerite Atti della Accademia Nazionale dei Lincei, 1967, 43, 212-224 |
9012740 | CIF | Cu O6 Sb2 | P 1 21/c 1 | 4.62; 4.62; 9.28 90; 88.5; 90 | 198.008 | Bystrom, A.; Hok, B.; Mason, B. The crystal structure of zinc metantimonate and similar compounds Arkiv for Kemi, Mineralogi och Geologi,, 1942, 1-8 |
9012741 | CIF | K O6 U V | P 1 21/c 1 | 6.59; 8.403; 10.43 90; 104.2; 90 | 559.922 | Sundberg, I.; Sillen, L. G. On the crystal structure of KUO2VO4 (synthetic anhydrous carnotite) Arkiv for Kemi, 1949, 1, 337-351 |
9012764 | CIF | Ba H6 O8 Si2 | P 1 21/c 1 | 7.837; 10.622; 8.46 90; 94.53; 90 | 702.049 | Coda, A.; dal Negro, A.; Rossi, G. The crystal structure of krauskopfite Atti della Accademia Nazionale dei Lincei, 1967, 42, 859-873 |
9012769 | CIF | F Mg2 O4 P | P 1 21/c 1 | 9.65; 12.731; 11.961 90; 108.22; 90 | 1395.78 | Amisano Canesi, A.; Chiari, G. Refinement of very-high-pressure wagnerite, Mg2(PO4)F European Crystallographic Meeting, 1992, 14, 189-189 |
9012784 | CIF | B6 H22 Mg O17 | P 1 21/c 1 | 12.664; 10.091; 11.322 90; 109.6; 90 | 1363.03 | dal Negro, A.; Ungaretti, L.; Basso, R. The crystal structure of synthetic hydrated borates: (II) MgO*3B2O3*7H2O Crystal Structure Communications, 1976, 5, 433-436 |
9012787 | CIF | H2 O7 Pb Si U | P 1 21/c 1 | 6.704; 6.932; 13.252 90; 104.22; 90 | 596.979 | Rosenzweig, A.; Ryan, R. R. Kasolite, Pb(UO2)(SiO4)*H2O Crystal Structure Communications, 1977, 6, 617-621 |
9012788 | CIF | O6 Pb Si U | P 1 21/c 1 | 6.66; 6.96; 13.23 90; 104; 90 | 595.042 | Huynen, A. M.; Piret-Meunier J; Van Meerssche, M. Structure de la kasolite Academie Royale de Belgique, Classe des Sciences: Bulletin, 1963, 49, 192-201 |
9012797 | CIF | C H10 Mg O8 | P 1 21/c 1 | 7.364; 7.632; 12.488 90; 101.75; 90 | 687.144 | Liu, B. N.; Zhou, X. T.; Cui, X. S.; Tang, J. G. Synthesis of lansfordite MgCO3*5H2O and its crystal structure investigation Science in China B, 1990, 33, 1350-1356 |
9012800 | CIF | Fe Pb4 S14 Sb6 | P 1 21/c 1 | 4.0235; 19.074; 15.737 90; 91.89; 90 | 1207.07 | Leone, P.; Le Leuch, L. M.; Palvadeau, P.; Molinie, P.; Moelo, Y. Single crystal structures and magnetic properties of two iron or manganese-lead-antimony sulfides: MPb4Sb6S14 (M: Fe, Mn) Solid State Sciences, 2003, 5, 771-776 |
9012801 | CIF | Mn Pb4 S14 Sb6 | P 1 21/c 1 | 4.0216; 19.178; 15.837 90; 91.89; 90 | 1220.78 | Leone, P.; Le Leuch, L. M.; Palvadeau, P.; Molinie, P.; Moelo, Y. Single crystal structures and magnetic properties of two iron or manganese-lead-antimony sulfides: MPb4Sb6S14 (M: Fe, Mn) Loclaity: synthetic Solid State Sciences, 2003, 5, 771-776 |
9012843 | CIF | Be0.96 Ce0.92 H O5 Si0.98 | P 1 21/c 1 | 4.7681; 7.6757; 9.9301 90; 90.171; 90 | 363.425 | Lulu, X. M.; Zhi-Zhong P Crystal structure of xinganite Geochemistry, 1986, 5, 280-285 |
9012868 | CIF | B H Mg0.094 Mn0.906 O3 | P 1 21/c 1 | 3.287; 10.718; 12.866 90; 94.75; 90 | 451.713 | Hoffmann, C.; Armbruster, T. Crystal structure of a (001) twinned sussexite Mn2B2O4(OH)2 from the Kalahari Manganese Field South Africa Locality: Nchwaning II Mine, Kalahari Manganese Field, South Africa Schweizerische Mineralogische und Petrographische Mitteilungen, 1995, 75, 123-133 |
9013072 | CIF | Al3 B2 H Mg2 O10 | P 1 21/c 1 | 7.455; 4.33; 9.825 90; 110.68; 90 | 296.718 | Daniels, P.; Krosse, S.; Werding, G.; Schreyer, W. "Pseudosinhalite", a new hydrous MgAl-borate: synthesis, phase characterization, crystal structure, and PT-stability Locality: synthetic Contributions to Mineralogy and Petrology, 1997, 128, 261-271 |
9013156 | CIF | Al3.96 Cu1.12 F2 Fe0.04 H28 O28.72 P4 V0.88 | P 1 21/c 1 | 4.961; 12.181; 18.974 90; 90.96; 90 | 1146.44 | Colchester, D. M.; Leverett, P.; McKinnon, A. R.; Sharpe, J. L.; Williams, P. A. Cloncurryite, Cu0.56(VO)0.44Al2(PO4)2(F,OH)2*5H2O, a new mineral from the Great Australia mine, Cloncurry, Queensland, Australia, and its relationship to nevadaite Locality: Great Australia mine, Concurry, Queensland, Australia Australian Journal of Mineralogy, 2007, 13, 5-14 |
9013160 | CIF | H46 K Na8 O46 Si9 | P 1 21/c 1 | 24.8219; 11.9236; 14.8765 90; 94.486; 90 | 4389.46 | Zubkova, N. V.; Pekov, I. V.; Chukanov, N. V.; Listsin, D. V.; Rabadanov, M. K.; Pushcharovsky, D. Y. New data on megacyclite New Data on Minerals. Moscow, 2007, 42, 81-92 |
9013302 | CIF | C H4 Ca4 O11 Si2 | P 1 21/c 1 | 7.573; 23.364; 11.544 90; 109.15; 90 | 1929.52 | Merlino, S.; Bonaccorsi, E.; Grabezhev, A. I.; Zadov, A. E.; Pertsev, N. N.; Chukanov, N. V. Fukalite: An example of an OD structure with two-dimensional disorder American Mineralogist, 2009, 94, 323-333 |
9013405 | CIF | F2 Fe H4 K2 O8 P2 | P 1 21/c 1 | 4.7586; 8.253; 10.758 90; 92.845; 90 | 421.975 | Mi, J. X.; Wang, C. X.; Wei, Z. B.; Chen, F. J.; Xu, C. Y.; Mao, S. Y. K2Fe[H(HPO4)2]F2 Acta Crystallographica, Section E, 2005, 61, i143-i145 |
9013408 | CIF | As0.91 Co0.13 Fe0.87 S1.09 | P 1 21/c 1 | 5.741; 5.649; 5.756 90; 110.588; 90 | 174.75 | Fuess, H.; Kratz, T.; Topel-Schadt J; Miehe, G. Crystal structure refinement and electron microscopy of arsenopyrite Note: structure was transformed to this setting from C2_1/d Zeitschrift fur Kristallographie, 1987, 179, 335-346 |
9013426 | CIF | O2 Si | P 1 21/c 1 | 8.378; 4.6018; 9.0568 90; 124.949; 90 | 286.205 | Dove, M. T.; Craig, M. S.; Keen, D. A.; Marshall, W. G.; Redfern, S. A. T.; Trachenko, K. O.; Tucker, M. G. Crystal structure of the high-pressure monoclinic phase-II of cristobalite, SiO2 Locality: synthetic Note: P = 3.5 GPa, refinement by unconstrained Rietveld analysis Mineralogical Magazine, 2000, 64, 569-576 |
9013427 | CIF | O2 Si | P 1 21/c 1 | 8.3769; 4.602; 9.0583 90; 124.939; 90 | 286.263 | Dove, M. T.; Craig, M. S.; Keen, D. A.; Marshall, W. G.; Redfern, S. A. T.; Trachenko, K. O.; Tucker, M. G. Crystal structure of the high-pressure monoclinic phase-II of cristobalite, SiO2 Locality: synthetic Note: P = 3.5 GPa, refinement by constrained Rietveld analysis Mineralogical Magazine, 2000, 64, 569-576 |
9013462 | CIF | As2 Cu3 O8 | P 1 21/c 1 | 6.327; 8.642; 11.313 90; 92.04; 90 | 618.179 | Poulsen, S. J.; Calvo, C. Crystal structure of Cu3(AsO4)2 Canadian Journal of Chemistry, 1968, 46, 917-927 |
9013470 | CIF | Hf O2 | P 1 21/c 1 | 5.1156; 5.1722; 5.2948 90; 99.18; 90 | 138.3 | Ruh, R.; Corfield, P. W. R. Crystal structure of monoclinic hafnia and comparison with monoclinic zirconia Locality: synthetic Journal of the American Ceramic Society, 1970, 53, 126-129 |
9013617 | CIF | Fe Ge2 Li O6 | P 1 21/c 1 | 9.893; 8.836; 5.379 90; 108.83; 90 | 445.038 | Nestola, F.; Redhammer, G. J.; Pamato, M. G.; Secco, L.; Dal Negro, A. High-pressure phase transformation in LiFeGe2O6 pyroxene Note: P = 0.00 GPa American Mineralogist, 2009, 94, 616-621 |
9013661 | CIF | H10 Mg Na2 O13 S2 | P 1 21/c 1 | 5.769; 23.951; 8.046 90; 95.425; 90 | 1106.76 | Leduc, E. M. S.; Peterson, R. C.; Wang, R. The crystal structure and hydrogen bonding of synthetic konyaite, Na2Mg(SO4)2*5H2O Locality: synthetic American Mineralogist, 2009, 94, 1005-1011 |
9013706 | CIF | Al0.02 Ca0.121 Fe1.008 Mg0.871 O6 Si1.98 | P 1 21/c 1 | 9.749; 8.937; 5.246 90; 108.49; 90 | 433.473 | Alvaro, M.; Nestola, F.; Ballaran, T. B.; Camara, F.; Domeneghetti, M. C.; Tazzoli, V. High-pressure phase transition of a natural pigeonite Note: P = 0.0001 GPa American Mineralogist, 2010, 95, 300-311 |
9013707 | CIF | Al0.02 Ca0.121 Fe1.008 Mg0.871 O6 Si1.98 | P 1 21/c 1 | 9.722; 8.941; 5.247 90; 108.5; 90 | 432.523 | Alvaro, M.; Nestola, F.; Ballaran, T. B.; Camara, F.; Domeneghetti, M. C.; Tazzoli, V. High-pressure phase transition of a natural pigeonite Note: P = 0.047 GPa American Mineralogist, 2010, 95, 300-311 |
9013708 | CIF | Al0.02 Ca0.121 Fe1.008 Mg0.871 O6 Si1.98 | P 1 21/c 1 | 9.701; 8.887; 5.226 90; 108.38; 90 | 427.564 | Alvaro, M.; Nestola, F.; Ballaran, T. B.; Camara, F.; Domeneghetti, M. C.; Tazzoli, V. High-pressure phase transition of a natural pigeonite Note: P = 0.984 GPa American Mineralogist, 2010, 95, 300-311 |
9013709 | CIF | Al0.02 Ca0.121 Fe1.008 Mg0.871 O6 Si1.98 | P 1 21/c 1 | 9.659; 8.877; 5.218 90; 108.09; 90 | 425.291 | Alvaro, M.; Nestola, F.; Ballaran, T. B.; Camara, F.; Domeneghetti, M. C.; Tazzoli, V. High-pressure phase transition of a natural pigeonite Note: P = 1.794 GPa American Mineralogist, 2010, 95, 300-311 |
9013710 | CIF | Al0.02 Ca0.121 Fe1.008 Mg0.871 O6 Si1.98 | P 1 21/c 1 | 9.621; 8.827; 5.199 90; 107.82; 90 | 420.34 | Alvaro, M.; Nestola, F.; Ballaran, T. B.; Camara, F.; Domeneghetti, M. C.; Tazzoli, V. High-pressure phase transition of a natural pigeonite Note: P = 3.167 GPa American Mineralogist, 2010, 95, 300-311 |
9013711 | CIF | Al0.02 Ca0.121 Fe1.008 Mg0.871 O6 Si1.98 | P 1 21/c 1 | 9.622; 8.861; 5.181 90; 107.92; 90 | 420.305 | Alvaro, M.; Nestola, F.; Ballaran, T. B.; Camara, F.; Domeneghetti, M. C.; Tazzoli, V. High-pressure phase transition of a natural pigeonite Note: P = 3.172 GPa American Mineralogist, 2010, 95, 300-311 |
9013794 | CIF | Ca3.58 Ce1.1 F0.9 H2.738 Na0.24 Nb0.04 O17.8 Si4 Ti0.96 Zr0.08 | P 1 21/c 1 | 7.398; 5.595; 18.662 90; 101.37; 90 | 757.294 | Bellezza, M.; Merlino, S.; Perchiazzi, N. Mosandrite: Structural and crystal-chemical relationships with rinkite Norway The Canadian Mineralogist, 2009, 47, 897-908 |
9013856 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5092; 8.5684; 5.2345 90; 109.86; 90 | 401.134 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 100 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013857 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5112; 8.5703; 5.2354 90; 109.88; 90 | 401.326 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 125 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013858 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5134; 8.5705; 5.2372 90; 109.91; 90 | 401.49 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 150 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013859 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5161; 8.5708; 5.2397 90; 109.92; 90 | 401.784 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 175 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013860 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5189; 8.5722; 5.2428 90; 109.93; 90 | 402.18 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 200 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013861 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5193; 8.5713; 5.2466 90; 109.99; 90 | 402.294 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 225 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013862 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5277; 8.5722; 5.2512 90; 109.99; 90 | 403.044 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 250 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013863 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5267; 8.5688; 5.2553 90; 110.06; 90 | 402.977 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 265 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013864 | CIF | Ga Li O6 Si2 | P 1 21/c 1 | 9.5405; 8.563; 5.2669 90; 110.15; 90 | 403.945 | Camara, F.; Nestola, F.; Angel, R. J.; Ohashi, H. Spontaneous strain variations through the low-temperature displacive phase transition of LiGaSi2O6 clinopyroxene Note: T = 280 K European Journal of Mineralogy, 2009, 21, 599-614 |
9013917 | CIF | Al2 Ca O4 | P 1 21/c 1 | 7.97187; 8.62844; 10.26276 90; 94.801; 90 | 703.445 | Lazic, B.; Kahlenberg, V.; Konzett, J. Structural studies on a stuffed framework high pressure polymorph of CaAl2O4 Zeitschrift fur Kristallographie, 2007, 222, 690-695 |
9013954 | CIF | Cd1.89 Cu3 H22.02 O18 S2 Zn0.11 | P 1 21/c 1 | 10.863; 13.129; 11.169 90; 113.04; 90 | 1465.86 | Elliot, P.; Brugger, J.; Caradoc-Davies T Description and crystal structure of a new mineral, edwardsite, Cu3Cd2(SO4)2(OH)6·4H2O, from Broken Hill, New South Wales, Australia Mineralogical Magazine, 2010, 74, 39-53 |
9013997 | CIF | H18 Na4 O19 Si4 | P 1 21/c 1 | 9.8744; 12.3981; 14.8973 90; 104.675; 90 | 1764.29 | Zubkova, N. V.; Pekov, I. V.; Pushcharovskii, D. Y.; Kazantsev, S. S. Crystal structure of yegorovite Na4[Si4O8(OH)4]*7H2O Doklady Earth Sciences, 2009, 427, 814-818 |
9014018 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8336; 7.6076; 9.6298 90; 90.165; 90 | 354.106 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
9014033 | CIF | Al Ca F6 H2 Na O | P 1 21/c 1 | 5.563; 5.541; 16.115 90; 96.35; 90 | 493.691 | Adhikesavalu, D.; Cameron, T. S.; Knop, O. Thomsenolite, NaCaAlF6*H2O: hydrogen bonding and comparison with pachnolite Canadian Journal of Chemistry, 1985, 63, 3322-3327 |
9014042 | CIF | Cu K2 O14 S2 | P 1 21/c 1 | 6.159; 12.131; 9.086 90; 104.45; 90 | 657.384 | Carapezza, M.; Di Sanseverino, L. R. Crystallography and genesis of double sulfates and their hydrates. II. Structure, powder pattern and thermoanalysis of cyanochroite, K2Cu(SO4)2*6H2O Mineralogica Petrographica Acta, 1968, 14, 23-37 |
9014043 | CIF | C2 H10 Ca Cl O7 | P 1 21/c 1 | 6.82; 13.72; 11.51 90; 116.7; 90 | 962.157 | Giuseppetti, G.; Tadini, C.; Ungaretti, L. La struttura cristallina della calclacite Periodico di Mineralogia, 1970, 39, 145-158 |
9014079 | CIF | Fe3 H20 K5 O35 S6 | P 1 21/c 1 | 9.491; 18.474; 18.109 90; 92.38; 90 | 3172.43 | Mereiter, K.; Vollenkle, H. Die Kristallstruktur von beta-pentakalium-[mu3-oxo-hexa-mu-sulfato- triquatriesen(III)]-Heptahydrat - eine monokline Modifikation des Masschen Salzes Acta Crystallographica, Section B, 1978, 34, 378-384 |
9014202 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8303; 7.6011; 9.6292 90; 90.18; 90 | 353.54 | 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 = 160 K American Mineralogist, 2010, 95, 1413-1421 |
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 |
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 |
9014478 | CIF | Li Nb3 O8 | P 1 21/c 1 | 7.459; 5.034; 15.27 90; 107.33; 90 | 547.339 | Gatehouse, B. M.; Leverett, P. Lithium triniobate(V), LiNb3O8 Note: isostructural with lithiotantite Crystal Structure Communications, 1972, 1, 83-86 |
9014552 | CIF | Ba0.02 Ca3.78 Ce0.36 F2.98 Gd0.02 La0.12 Mn0.02 Na2.04 Nb0.14 Nd0.18 O15.02 Pr0.04 Si4 Sm0.02 Sr0.24 Ti0.85 Y0.06 Zr0.01 | P 1 21/c 1 | 7.424; 5.7083; 18.941 90; 101.424; 90 | 786.787 | 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 3471 Mineralogical Magazine, 2011, 75, 2755-2774 |
9014571 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8361; 7.6155; 9.6392 90; 90.134; 90 | 355.004 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
9014586 | CIF | K3 Mo4 O22 P4 | P 1 21/c 1 | 9.721; 9.805; 12.329 90; 128.73; 90 | 916.723 | Guesdon, A.; Borel, M.; Leclaire, A.; Grandin, A.; Raveau, B. A series of Mixed-valent Molybdenum Monophosphates, Isotypic with Leucophosphite Represented by CsMo2P2O10 and K1.5Mo2P2O10.H2O _cod_database_code 1001554 Zeitschrift fur Anorganische und Allgemeine Chemie, 1993, 619, 1841-1849 |
9014592 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8356; 7.6114; 9.6341 90; 90.158; 90 | 354.588 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
9014647 | CIF | O8 Pb2 Te1.25 U0.75 | P 1 21/c 1 | 5.722; 7.7478; 7.889 90; 90.833; 90 | 349.705 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Marty, J.; Thorne, B. Lead-tellurium oxysalts from Otto Mountain near Baker, California: IV. Markcooperite, Pb(UO2)Te6+O6, the first natural uranyl tellurate American Mineralogist, 2010, 95, 1554-1559 |
9014649 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8354; 7.6082; 9.6335 90; 90.158; 90 | 354.403 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
9014651 | CIF | H3 K O8 S U | P 1 21/c 1 | 8.0462; 7.9256; 11.3206 90; 107.726; 90 | 687.651 | Plasil, J.; Hlousek, J.; Veselovsky, F.; Fejfarova, K.; Dusek, M.; Skoda, R.; Novak, M.; Cejka, J.; Sejkora, J.; Ondrus, P. Adolfpateraite, K(UO2)(SO4)(OH)(H2O), a new uranyl, sulphate mineral from Jachymov, Czech Republic American Mineralogist, 2012, 97, 447-454 |
9014714 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8355; 7.6102; 9.6317 90; 90.15; 90 | 354.437 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
9014740 | CIF | Ca4 F2 O7 Si2 | P 1 21/c 1 | 7.518; 10.521; 10.906 90; 70.7; 90 | 814.152 | Saburi, S.; Kawahara, A.; Henmi, C.; Kusachi, I.; Kihara, K. The refinement of the crystal structure of cuspidine Mineralogical Journal, 1977, 8, 286-298 |
9014760 | CIF | Br0.13 Cl4.87 K0.94 Pb2 Tl0.06 | P 1 21/c 1 | 8.8989; 7.9717; 12.5624 90; 90.022; 90 | 891.169 | Mitolo, D.; Pinto, D.; Garavelli, A.; Bindi, L.; Vurro, F. The role of the minor substitutions in the crystal structure of natural challacolloite, KPb2Cl5, and hephaistosite, TiPb2Cl5, from Vulcano (Aeolian Archipelago, Italy) Mineralogy and Petrology, 2009, 96, 121-128 |
9014822 | CIF | Ag Pb S6 Sb3 | P 1 21/c 1 | 19.1686; 17.16; 13.042 90; 90.008; 90 | 4289.95 | Nespolo, M.; Ozawa, T.; Kawasaki, Y.; Sugiyama, K. Structural relations and pseudosymmetries in the andorite homologous series Journal of Mineralogical and Petrological Sciences, 2012, 107, 226-243 |
9014840 | CIF | Ca4 F2 O7 Si2 | P 1 21/c 1 | 7.55; 10.43; 10.85 90; 69.93; 90 | 802.515 | Smirnova, R. F.; Rumanova, I. M.; Belov, N. V. Crystal structure of cuspidine Zapiski Vsesoyuznogo Mineralogicheskogo Obshchestva, 1955, 84, 159-169 |
9014859 | CIF | Fe0.85 Mg0.49 Mn1.66 O8 P2 | P 1 21/c 1 | 6.088; 4.814; 10.484 90; 89.42; 90 | 307.245 | Hatert, F.; Roda-Robles E; de Parseval, P.; Wouters, J. Zavaliaite, (Mn2+,Fe2+,Mg)3(PO4)2, a new member of the sarcopside group from La Empleada pegmatite, San Luis Province, Argentina The Canadian Mineralogist, 2012, 50, 1445-1452 |
9014928 | CIF | As3 Ca4 H9 O16 | P 1 21/c 1 | 5.822; 10.175; 22.8816 90; 96.902; 90 | 1345.66 | Yang, H.; Evans, S. H.; Downs, R. T.; Jenkins, R. A. The crystal structure of vladimirite, with a revised chemical formula, Ca4(AsO4)2(AsO3OH)*4H2O Note: Sample R080001 The Canadian Mineralogist, 2011, 49, 1055-1064 |
9014971 | CIF | B5 Ca2 H7 O13 | P 1 21/c 1 | 11.58; 6.9844; 12.352 90; 110.573; 90 | 935.309 | Sun, W.; Huang, Y.-X.; Li, Z.; Pan, Y.; Mi, J.-X. Hydrothermal synthesis and single-crystal X-ray structure refinement of three borates: sibirskite, parasibirskite and priceite Note: T = 173 K The Canadian Mineralogist, 2011, 49, 823-834 |
9014977 | CIF | Fe0.093 Mg0.908 O3 Si | P 1 21/c 1 | 17.87; 8.526; 4.9485 90; 92.88; 90 | 752.999 | Zhang, J. S.; Dera, P.; Bass, J. D. A new high-pressure phase transition in natural Fe-bearing orthoenstatite Note: P = 14.26 GPa American Mineralogist, 2012, 97, 1070-1074 |
9014981 | CIF | Ca4.16 Ce0.3 F2.96 La0.16 Mn0.02 Na2.08 Nb0.29 Nd0.08 O15.04 Pr0.04 Si4 Sr0.02 Ti0.67 Y0.08 Zr0.04 | P 1 21/c 1 | 7.4132; 5.6816; 18.8455 90; 101.37; 90 | 778.173 | 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 H-08-02 Mineralogical Magazine, 2011, 75, 2755-2774 |
9015068 | CIF | Cu2 S | P 1 21/c 1 | 15.246; 11.884; 13.494 90; 116.35; 90 | 2190.86 | Evans, H. T. Crystal structure of low chalcocite Nature Physical Science, 1971, 232, 69-70 |
9015115 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8332; 7.6082; 9.6342 90; 90.147; 90 | 354.267 | Rinaldi, R.; Gatta, G. D.; Angel, R. J. Crystal chemistry and low-temperature behavior of datolite: a single-crystal X-ray diffraction study American Mineralogist, 2010, 95, 1413-1421 |
9015127 | CIF | Cu3 O8 V2 | P 1 21/c 1 | 6.2493; 7.9936; 6.3776 90; 111.49; 90 | 296.441 | Shannon, R. D.; Calvo, C. Crystal structure of a new form of Cu3V2O8 Canadian Journal of Chemistry, 1972, 50, 3944-3949 |
9015159 | CIF | As Cu3 H3 O7 | P 1 21/c 1 | 7.24; 6.46; 12.38 90; 99.5; 90 | 571.077 | Ghose, S.; Fehlmann, M.; Sundaralingam, M. The crystal structure of clinoclase, Cu3AsO4(OH)3 Acta Crystallographica, 1965, 18, 777-787 |
9015215 | CIF | As2 Cu3 O8 | P 1 21/c 1 | 6.306; 8.643; 11.31 90; 92.26; 90 | 615.947 | Starova, G. L.; Vergasova, L. P.; Filatov, S. K.; Britvin S N. Ananyev V V Lammerite-beta, Cu3(AsO4)2 - a new mineral from fumaroles of the Great Fissure Tolbachic eruption (Kamchatka, Russia) Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva, 2011, 140, 46-51 |
9015228 | CIF | As3 Ca4 H9 O16 | P 1 21/c 1 | 5.8279; 10.1802; 22.8944 90; 96.943; 90 | 1348.35 | Yang, H.; Evans, S. H.; Downs, R. T.; Jenkins, R. A. The crystal structure of vladimirite, with a revised chemical formula, Ca4(AsO4)2(AsO3OH)*4H2O Note: Sample R100075 The Canadian Mineralogist, 2011, 49, 1055-1064 |
9015253 | CIF | Ca3.48 Ce0.5 F2.6 La0.18 Na2.28 Nb0.33 Nd0.24 O15.4 Pr0.06 Si4 Sm0.04 Ti0.64 Y0.1 Zr0.03 | P 1 21/c 1 | 7.4328; 5.6595; 18.8181 90; 101.353; 90 | 776.112 | 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 1991c Mineralogical Magazine, 2011, 75, 2755-2774 |
9015286 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.833; 7.6074; 9.631 90; 90.175; 90 | 354.097 | 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 = 250 K American Mineralogist, 2010, 95, 1413-1421 |
9015302 | CIF | As Pb S4 Sb | P 1 21/c 1 | 8.527; 7.971; 20.102 90; 101.814; 90 | 1337.36 | Makovicky, E.; Topa, D.; Tajjedin, H.; Rastad, E.; Yaghubpur, A. The crystal structure of guettardite, PbAsSbS4, and the twinnite-guettardite problem The Canadian Mineralogist, 2012, 50, 253-265 |
9015309 | CIF | O2 Si | P 1 21/c 1 | 7.803; 4.382; 8.366 90; 118.7; 90 | 250.913 | Dera, P.; Lazarz, J. D.; Prakapenka, V. B.; Barkley, M.; Downs, R. T. New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 10.1 GPa Physics and Chemistry of Minerals, 2011, 38, Online-first |
9015355 | CIF | O2 Ti | P 1 21/c 1 | 4.589; 4.849; 4.736 90; 98.6; 90 | 104.201 | Swamy, V.; Dubrovinsky, L. S.; Dubrovinskaia, N. A.; Langenhorst, F.; Simionovici, A. S.; Drakopoulos, M.; Dmitriev, V.; Weber, H. P. Size effects on the structure and phase transition behavior of baddeleyite TiO2 Solid State Communications, 2005, 134, 541-546 |
9015365 | CIF | Fe Ge2 Li O6 | P 1 21/c 1 | 9.765; 8.721; 5.301 90; 108.49; 90 | 428.133 | Nestola, F.; Redhammer, G. J.; Pamato, M. G.; Secco, L.; Dal Negro, A. High-pressure phase transformation in LiFeGe2O6 pyroxene Note: P = 4.16 GPa American Mineralogist, 2009, 94, 616-621 |
9015367 | CIF | As H3 O6 Zn2 | P 1 21/c 1 | 12.76; 7.93; 10.21 90; 104.4; 90 | 1000.66 | Pushcharovskii, D. Y.; Pobedimskaya, E. A.; Belov, N. V. The crystal structure of legrandite Zn2[AsO4]OH*H2O Soviet Physics - Doklady, 1971, 16, 419-421 |
9015388 | CIF | Cu2.64 Mo0.04 O8 V1.94 Zn0.36 | P 1 21/c 1 | 6.2695; 8.0195; 6.362 90; 111.96; 90 | 296.662 | Zelenski, M. E.; Zubkova, N. V.; Pekov, I. V.; Boldyreva, M. M.; Pushcharovsky, D. Y.; Nekrasov, A. N. Pseudolyonsite, Cu3(VO4)2, a new mineral species from the Tolbachik volcano, Kamchatka Peninsula, Russia European Journal of Mineralogy, 2011, 23, 475-481 |
9015392 | CIF | O2 Si | P 1 21/c 1 | 7.894; 4.456; 8.582 90; 119.7; 90 | 262.22 | Dera, P.; Lazarz, J. D.; Prakapenka, V. B.; Barkley, M.; Downs, R. T. New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 7.4 GPa Physics and Chemistry of Minerals, 2011, 38, Online-first |
9015447 | CIF | Li P | P 1 21/c 1 | 5.582; 4.94; 10.255 90; 118.15; 90 | 249.334 | Honle, W.; Schnering, H. G. Zur Struktur von LiP und KSb Zeitschrift fur Kristallographie, 1981, 155, 307-314 |
9015453 | CIF | Ca2.92 Ce0.54 F2.76 Gd0.04 La0.24 Na2.9 Nb0.75 Nd0.18 O15.24 Pr0.06 Si4 Sm0.04 Sr0.04 Ta0.01 Ti0.24 Y0.04 | P 1 21/c 1 | 7.468; 5.689; 18.891 90; 101.37; 90 | 786.841 | Sokolova, E.; Hawthorne, F. C. From structure topology to chemical composition. V. Titanium silicates: The crystal chemistry of nacareniobsite-(Ce) The Canadian Mineralogist, 2008, 46, 1333-1342 |
9015574 | CIF | Br0.18 Cl4.82 K0.04 Pb2 Tl0.96 | P 1 21/c 1 | 9.0026; 7.9723; 12.5693 90; 90.046; 90 | 902.116 | Mitolo, D.; Pinto, D.; Garavelli, A.; Bindi, L.; Vurro, F. The role of the minor substitutions in the crystal structure of natural challacolloite, KPb2Cl5, and hephaistosite, TiPb2Cl5, from Vulcano (Aeolian Archipelago, Italy) Mineralogy and Petrology, 2009, 96, 121-128 |
9015595 | CIF | H10 Mg Na2 O13 S2 | P 1 21/c 1 | 5.7594; 23.914; 8.025 90; 95.288; 90 | 1100.58 | Mills, S. J.; Wilson, S. A.; Dipple, G. M.; Raudsepp, M. The decomposition of konyaite: importance in CO2 fixation in mine tailings Mineralogical Magazine, 2010, 74, 903-917 |
9015660 | CIF | H8 Mo O10 U | P 1 21/c 1 | 6.32; 7.5; 57.8 90; 94; 90 | 2733.05 | Makarov, E. S.; Anikina, L. I. Crystal structure of umohoite (UMoO6(H2O)2)*2H2O Geochemistry, 1963, 1, 14-21 |
9015669 | CIF | Ca4.28 Ce0.9 F2.7 Na1.82 Nb0.05 O15.3 Si4 Ti0.86 Zr0.09 | P 1 21/c 1 | 7.421; 5.709; 19.019 90; 101.23; 90 | 790.34 | Bellezza, M.; Merlino, S.; Perchiazzi, N.; Raade, G. <<Johnstrupite>>: a chemical and structural study Atti della Societa Toscana di Scienze Naturali, Memorie, Serie A, 2009, 114, 1-3 |
9015783 | CIF | Cl Fe H12 O10 S | P 1 21/c 1 | 10.6776; 6.9148; 14.1193 90; 111.407; 90 | 970.558 | Jingliang, Z.; Li, J.; Wei, D. The crystal structure of xitieshanite Kexue Tongbao, 1988, 33, 502-505 |
9015786 | CIF | As2 Ca2 Cu H4 O10 | P 1 21/c 1 | 5.8618; 12.7854; 5.7025 90; 109.425; 90 | 403.049 | Yang, H.; Jenkins, R. A.; Downs, R. T.; Evans, S. H.; Tait, K. T. Rruffite, Ca2Cu(AsO4)2*2H2O, a new member of the roselite group, from Tierra Amarilla, Chile The Canadian Mineralogist, 2011, 49, 877-884 |
9015834 | CIF | Al0.08 As1.482 Fe2.81 H10 O14 P0.526 | P 1 21/c 1 | 10.2; 9.718; 5.5432 90; 94.05; 90 | 548.09 | Kolitsch, U.; Atencio, D.; Chukanov, N. V.; Zubkova, N. V.; Menezes, L. A. D.; Coutinho, J. M. V.; Birch, W. D.; Schluter, J.; Pohl, D.; Kampf, A. R.; Steele, I. M.; Favreau, G.; Nasdala, L.; Mockel, S.; Giester, G.; Pushcharovsky, D. Y. Bendadaite, a new iron arsenate mineral of the arthurite group Mineralogical Magazine, 2010, 74, 469-486 |
9015847 | CIF | Fe Ge2 Li O6 | P 1 21/c 1 | 9.801; 8.769; 5.331 90; 108.66; 90 | 434.088 | Nestola, F.; Redhammer, G. J.; Pamato, M. G.; Secco, L.; Dal Negro, A. High-pressure phase transformation in LiFeGe2O6 pyroxene Note: P = 2.54 GPa American Mineralogist, 2009, 94, 616-621 |
9015868 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8355; 7.6085; 9.6326 90; 90.159; 90 | 354.391 | 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 = 280 K American Mineralogist, 2010, 95, 1413-1421 |
9015909 | CIF | B Ca H O3 | P 1 21/c 1 | 3.5624; 9.5225; 8.6231 90; 119.452; 90 | 254.718 | Sun, W.; Huang, Y.-X.; Li, Z.; Pan, Y.; Mi, J.-X. Hydrothermal synthesis and single-crystal X-ray structure refinement of three borates: sibirskite, parasibirskite and priceite Note: T = 295 K The Canadian Mineralogist, 2011, 49, 823-834 |
9015923 | CIF | Fe Ge2 Li O6 | P 1 21/c 1 | 9.843; 8.794; 5.352 90; 108.7; 90 | 438.81 | Nestola, F.; Redhammer, G. J.; Pamato, M. G.; Secco, L.; Dal Negro, A. High-pressure phase transformation in LiFeGe2O6 pyroxene Note: P = 1.25 GPa American Mineralogist, 2009, 94, 616-621 |
9015965 | CIF | Cl5 K Pb2 | P 1 21/c 1 | 8.864; 7.932; 12.491 90; 90.153; 90 | 878.23 | Schluter, J.; Pohl, D.; Britvin, S. The new mineral challacolloite, KPb2Cl5, the natural occurrence of a technically known laser material Neues Jahrbuch fur Mineralogie, Abhandlungen, 2005, 182, 95-101 |
9016016 | CIF | K Sb | P 1 21/c 1 | 5.582; 4.94; 10.255 90; 118.15; 90 | 249.334 | Honle, W.; Schnering, H. G. Zur Struktur von LiP und KSb Zeitschrift fur Kristallographie, 1981, 155, 307-314 |
9016070 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8284; 7.5995; 9.631 90; 90.18; 90 | 353.393 | 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 = 100 K American Mineralogist, 2010, 95, 1413-1421 |
9016118 | CIF | O7 P V | P 1 21/c 1 | 7.613; 7.431; 9.482 90; 95.44; 90 | 534.002 | Le Bail, A.; Ferey, G.; Amoros, P.; Beltran-Portier D Structure of vanadyl hydrogenphosphate dihydrate alpha-VO(HPO4)*2H2O solved from X-ray and neutron powder diffraction _cod_database_code 1000083 European Journal of Solid State and Inorganic Chemistry, 1989, 26, 419-426 |
9016136 | CIF | B O8 P Th2 | P 1 21/c 1 | 8.4665; 7.9552; 8.2297 90; 103.746; 90 | 538.417 | Lipp, C.; Burns, P. C. Th2[BO4][PO4]: a rare example of an actinide borate-phosphate The Canadian Mineralogist, 2011, 49, 1211-1220 |
9016163 | CIF | F0.24 H1.32 Mg4.7 O9.76 Si2 Ti0.3 | P 1 21/c 1 | 7.88; 4.726; 10.29 90; 109.04; 90 | 362.244 | Pekov, I. V.; Gerasimova, E. I.; Chukanov, N. V.; Kabalov, Y. K.; Zubkova, N. V.; Zadov, A. E.; Yapaskurt, V. O.; Gekimyants, V. M.; Pushcharovskii, D. Y. Hydroxylchondrodite Mg5(SiO4)2(OH)2: a new mineral of the humite group and its crystal structure Doklady Akademii Nauk, 2011, 436, 526-532 |
9016167 | CIF | Ca Fe2 H16 Mg0.464 Mn O25 P4 Zn2.036 | P 1 21/c 1 | 6.3868; 21.26; 15.365 90; 90.564; 90 | 2086.21 | Kampf, A. R.; Mills, S. J.; Simmons, W. B.; Nizamoff, J. W.; Whitmore, R. W. Falsterite, Ca2MgMn2+2(Fe2+0.5Fe3+0.5)4Zn4(PO4)8(OH)4(H2O)14, a new secondary phosphate mineral from the Palermo No. 1 pegmatite, North Groton, New Hampshire American Mineralogist, 2012, 97, 496-502 |
9016177 | CIF | As1.079 H6.74 O7.87 Zn2 | P 1 21/c 1 | 11.793; 9.1138; 6.8265 90; 103.859; 90 | 712.346 | Cooper, M. A.; Abdu, Y. A.; Ball, N. A.; Hawthorne, F. C.; Back, M. E.; Tait, K. T.; Schluter, J.; Malcherek, T.; Pohl, D.; Gebhard, G. Ianbruceite, ideally [Zn2(OH)(H2O)(AsO4)](H2O)2, a new arsenate mineral from the Tsumeb mine, Otjikoto (Oshikoto) region, Namibia: description and crystal structure Mineralogical Magazine, 2012, 76, 1119-1131 |
9016220 | CIF | Ca H7 K O13 Si4 | P 1 21/c 1 | 6.4897; 6.9969; 26.714 90; 94.597; 90 | 1209.12 | Zubkova, N. V.; Filinchuk, Y. E.; Pekov, I. V.; Pushcharovsky, D. Y.; Gobechiya, E. R. Crystal structures of shlykovite and cryptophyllite: comparative crystal chemistry of phyllosilicate minerals of the mountainite family European Journal of Mineralogy, 2010, 22, 547-555 |
9016225 | CIF | O2 Si | P 1 21/c 1 | 8.011; 4.544; 8.89 90; 121; 90 | 277.391 | Dera, P.; Lazarz, J. D.; Prakapenka, V. B.; Barkley, M.; Downs, R. T. New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 4.9 GPa Physics and Chemistry of Minerals, 2011, 38, Online-first |
9016236 | CIF | Ba0.02 Ca3.58 Ce0.46 Dy0.02 F2.82 Gd0.02 La0.18 Na2.2 Nb0.12 Nd0.18 O15.18 Pr0.06 Si4 Sm0.04 Sr0.14 Ti0.85 Y0.12 Zr0.03 | P 1 21/c 1 | 7.4263; 5.6774; 18.8261 90; 101.39; 90 | 778.115 | 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 YuksFe Mineralogical Magazine, 2011, 75, 2755-2774 |
9016301 | CIF | Fe O4 Sb2 | P 1 21/c 1 | 5.7792; 8.3134; 8.4545 90; 91.879; 90 | 405.976 | Hinrichsen, B.; Dinnebier, R. E.; Rajiv, P.; Hanfland, M.; Grzechnik, A.; Jansen, M. Advances in data reduction of high-pressure X-ray powder diffraction data from two-dimensional detectors: a case study of schafarzikite (FeSb2O4) Note: P = 4.2 GPa, this is denoted as Phase II Journal of Physics: Condensed Matter, 2006, 18, S1021-S1037 |
9016331 | CIF | C H0.218 Ca7 O15.109 Si3 | P 1 21/c 1 | 18.7872; 6.7244; 10.4673 90; 90.788; 90 | 1322.24 | Lazic, B.; Armbruster, T.; Savelyeva, V. B.; Zadov, A. E.; Pertsev, N. N.; Dzierzanowski, P. Galuskinite, Ca7(SiO4)3(CO3), a new skarn mineral from the Birkhin gabbro massif, Eastern Siberia, Russia Mineralogical Magazine, 2011, 75, 2631-2648 |
9016400 | CIF | O2 Si | P 1 21/c 1 | 8.011; 4.544; 8.89 90; 121; 90 | 277.391 | Dera, P.; Lazarz, J. D.; Prakapenka, V. B.; Barkley, M.; Downs, R. T. New insights into the high-pressure polymorphism of SiO2 cristobalite Note: P = 3.5 GPa, data transformed from Dove et al (2000) Physics and Chemistry of Minerals, 2011, 38, Online-first |
9016424 | CIF | Ag0.986 Bi2.905 Pb S6 Sb0.109 | P 1 21/c 1 | 7.0567; 19.6905; 8.2219 90; 106.961; 90 | 1092.74 | Makovicky, E.; Topa, D. The crystal structure of gustavite, PbAgBi3S6 Analysis of twinning and polytypism using the OD approach European Journal of Mineralogy, 2011, 23, 537-550 |
9016429 | CIF | B H2 O2 | P 1 21/c 1 | 7.409; 7.666; 7.0421 90; 116.04; 90 | 359.371 | Baber, R. A.; Norman, N. C.; Orpen, A. G.; Rossi, J. The solid-state structure of diboronic acid, B2(OH)4 New Journal of Chemistry, 2003, 27, 772-775 |
9016452 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8298; 7.6002; 9.6321 90; 90.183; 90 | 353.568 | 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 = 130 K American Mineralogist, 2010, 95, 1413-1421 |
9016512 | CIF | B Ca H O5 Si | P 1 21/c 1 | 4.8308; 7.6011; 9.629 90; 90.176; 90 | 353.569 | 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 = 190 K American Mineralogist, 2010, 95, 1413-1421 |
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 |
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 |
9016639 | CIF | As Fe S | P 1 21/c 1 | 5.7612; 5.6841; 5.7674 90; 111.721; 90 | 175.456 | Bindi, L.; Moelo, Y.; Leone, P.; Suchaud, M. Stoichiometric arsenopyrite, FeAsS, from La Roche-Balue Quarry, Loire-Atlantique, France: Crystal structure and Mossbauer study The Canadian Mineralogist, 2012, 50, 471-479 |
9016678 | CIF | H12 Li2 O20 Se2 U3 | P 1 21/c 1 | 7.5213; 7.0071; 17.3282 90; 98.834; 90 | 902.406 | Wylie, E. M.; Burns, P. C. Crystal structures of six new uranyl selenate and selenite compounds and their relationship with uranyl mineral structures Note: Compound 5 The Canadian Mineralogist, 2012, 50, 147-157 |
9016695 | CIF | Cu F4 Nb O6 | P 1 21/c 1 | 5.59; 9.978; 7.544 90; 103.36; 90 | 409.394 | Crosnier-Lopez M; Duroy, H.; Fourquet, J. About the crystal structure of CuNb(OH,F)7*3H2O _cod_database_code 1000364 Journal of Solid State Chemistry, 1994, 108, 398-401 |
9016714 | CIF | O2 Zr | P 1 21/c 1 | 5.1505; 5.2116; 5.3173 90; 99.23; 90 | 140.881 | Howard, C. J.; Hill, R. J.; Reichert, B. E. Structures of the ZrO2 polymorphs at room temperature by high-resolution neutron powder diffraction Acta Crystallographica, Section B, 1988, 44, 116-120 |
9016798 | CIF | Fe0.26 H1.32 O4 Ti1.467 | P 1 21/c 1 | 7.5259; 4.5741; 9.854 90; 130.784; 90 | 256.847 | Grey, I. E.; Bordet, P.; Wilson, N. C.; Townend, R.; Bastow, T. J.; Brunelli, M. A new Al-rich hydroxylian pseudorutile from Kalimantan, Indonesia American Mineralogist, 2010, 95, 161-170 |
9016920 | CIF | Ag Bi1.47 Pb S6 Sb1.53 | P 1 21/c 1 | 6.9764; 19.3507; 8.387 90; 107.519; 90 | 1079.71 | Yang, H.; Downs, R. T.; Evans, S. H.; Pinch, W. W. Terrywallaceite, AgPb(Sb,Bi)3S6, isotypic with gustavite, a new mineral from Mina Herminia, Julcani Mining District, Huancavelica, Peru American Mineralogist, 2013, 98, 1310-1131 |
9016932 | CIF | Cu1.75 H7 O9 P Zn1.25 | P 1 21/c 1 | 7.4863; 10.1933; 9.7895 90; 103.18; 90 | 727.36 | Danisi, R. M.; Armbruster, T.; Lazic, B.; Vulic, P.; Kaindl, R.; Dimitrijevic, R.; Kahlenberg, V. In situ dehydration behavior of veszelyite (Cu,Zn)2Zn(PO4)(OH)3*2H2O: A single-crystal X-ray study Note: T = 173 K American Mineralogist, 2013, 98, 1261-1269 |
9016933 | CIF | Cu2 H7 O9 P Zn | P 1 21/c 1 | 7.5096; 10.2281; 9.8258 90; 103.304; 90 | 734.455 | Danisi, R. M.; Armbruster, T.; Lazic, B.; Vulic, P.; Kaindl, R.; Dimitrijevic, R.; Kahlenberg, V. In situ dehydration behavior of veszelyite (Cu,Zn)2Zn(PO4)(OH)3*2H2O: A single-crystal X-ray study Note: T = 296 K American Mineralogist, 2013, 98, 1261-1269 |
9016934 | CIF | Cu2 H5 O8 P Zn | P 1 21/c 1 | 7.252; 9.233; 10.52 90; 102.076; 90 | 688.808 | Danisi, R. M.; Armbruster, T.; Lazic, B.; Vulic, P.; Kaindl, R.; Dimitrijevic, R.; Kahlenberg, V. In situ dehydration behavior of veszelyite (Cu,Zn)2Zn(PO4)(OH)3*2H2O: A single-crystal X-ray study Note: T = 473 K American Mineralogist, 2013, 98, 1261-1269 |
9016937 | CIF | Cu2 H2 O8.5 Pb0.999 S0.5 Te | P 1 21/c 1 | 14.3126; 5.2267; 9.4878 90; 106.815; 90 | 679.414 | Kampf, A. R.; Mills, S. J.; Housley, R. M.; Rossman, G. R.; Marty, J.; Thorne, B. Lead-tellurium oxysalts from Otto Mountain near Baker, California: X. Bairdite, Pb2Cu2+4Te6+2O10(OH)2(SO4)(H2O), a new mineral with thick HCP layers American Mineralogist, 2013, 98, 1315-1321 |
9016967 | CIF | Al2 Ca H9 O12.5 Si2 | P 1 21/c 1 | 10.0214; 10.5997; 9.8327 90; 92.363; 90 | 1043.58 | Wadoski-Romeijn E; Armbruster, T. Topotactic transformation and dehydration of the zeolite gismondine to a novel Ca feldspar structure Note: T = 25 C, Phase A, Path 1 American Mineralogist, 2013, 98, 1988-1997 |
9017021 | CIF | He O2 Si | P 1 21/c 1 | 8.062; 4.797; 9.491 90; 120.43; 90 | 316.488 | Matsui, M.; Sato, T.; Funamori, N. Crystal structures and stabilities of cristobalite-helium phases at high pressures Note: P = 10 GPa American Mineralogist, 2014, 99, 184-189 |
9017024 | CIF | Al0.12 Ca0.55 Ce0.01 Fe1.41 K0.04 La0.02 Mg0.05 Mn0.26 Na2.45 O24 Si8 Sr3.84 Ti0.01 Zn0.16 | P 1 21/c 1 | 5.21381; 7.9143; 26.0888 90; 90.3556; 90 | 1076.5 | Chakhmourdian, A. R.; Cooper, M. A.; Ball, N.; Reguir, E. P.; Medici, L.; Abdu, Y. A.; Antonov, A. A. Vladykinite, Na3Sr4(Fe2+Fe3+)Si8O24: A new complex sheet silicate from peralkaline rocks of the Murun complex, eastern Siberia, Russia American Mineralogist, 2014, 99, 235-241 |
9017044 | CIF | Ba0.01 Be2 Ca0.05 O8 P2 Sr0.87 | P 1 21/c 1 | 7.997; 8.979; 8.42 90; 90.18; 90 | 604.596 | Rao, C.; Wang, R.; Hatert, F.; Gu, X.; Ottolini, L.; Hu, H.; Dong, C.; Bo, F. D.; Baijot, M. Strontiohurlbutite, SrBe2(PO4)2, a new mineral from Nanping No. 31 pegmatite, Fujian Province, Southeastern China American Mineralogist, 2014, 99, 494-499 |
9017075 | CIF | H12 N2 O12 S2 U | P 1 21/c 1 | 7.736; 7.3712; 20.856 90; 102.123; 90 | 1162.76 | Pekov, I. V.; Krivovichev, S. V.; Yapaskurt, V. O.; Chukanov, N. V.; Belakovskiy, D. I. Beshtauite, (NH4)2(UO2)(SO4)2*2H2O, a new mineral from Mount Beshtau, Northern Caucasus, Russia American Mineralogist, 2014, 99, 1783-1787 |
9017081 | CIF | H6 Mo2 O11 Th | P 1 21/c 1 | 9.6797; 10.3771; 9.3782 90; 90; 90 | 942.014 | Orlandi, P.; Biagioni, C.; Bindi, L.; Nestola, F. Ichnusaite, Th(MoO4)2*3H2O, the first natural thorium molybdate: occurrence, description, and crystal structure American Mineralogist, 2014, 99, 2089-2094 |
9017164 | CIF | As H3 O6 Zn2 | P 1 21/c 1 | 12.8052; 7.9249; 10.2173 90; 104.433; 90 | 1004.13 | Hawthorne, F. C.; Abdu, Y. A.; Tait, K. T. Hydrogen bonding in the crystal structure of legrandite: Zn2(AsO4)(OH)(H2O) The Canadian Mineralogist, 2013, 51, 233-241 |
9017166 | CIF | Be2.264 Ca1.161 Fe0.917 H6 O17 Si4.736 | P 1 21/c 1 | 8.7499; 4.916; 31.431 90; 90.1574; 90 | 1351.98 | Grice, J. D.; Kristiansen, R.; Friis, H.; Rowe, R.; Poirier, G. G.; Selbekk, R. S.; Cooper, M. A.; Larsen, A. O. Ferrochiavennite, a new beryllium silicate zeolite from syenite pegmatites in the Larvik Plutonic Complex, Oslo Region, Southern Norway The Canadian Mineralogist, 2013, 51, 285-296 |
9017173 | CIF | Ca0.26 Fe1.4 Mg0.02 Mn1.31 O8 P2 Zn0.01 | P 1 21/c 1 | 8.8052; 11.4793; 6.1388 90; 99.192; 90 | 612.527 | Tait, K. T.; Hawthorne, F. C.; Wise, M. A. The crystal chemistry of the graftonite-beusite minerals Notes: Sample B1 The Canadian Mineralogist, 2013, 51, 653-662 |
9017174 | CIF | Ca0.36 Fe0.67 Mg0.21 Mn1.75 O8 P2 Zn0.01 | P 1 21/c 1 | 8.79; 11.5382; 6.1654 90; 99.199; 90 | 617.258 | Tait, K. T.; Hawthorne, F. C.; Wise, M. A. The crystal chemistry of the graftonite-beusite minerals Notes: Sample B2 The Canadian Mineralogist, 2013, 51, 653-662 |
9017175 | CIF | Ca0.36 Fe0.67 Mg0.21 Mn1.75 O8 P2 Zn0.01 | P 1 21/c 1 | 8.7919; 11.5414; 6.1669 90; 99.192; 90 | 617.725 | Tait, K. T.; Hawthorne, F. C.; Wise, M. A. The crystal chemistry of the graftonite-beusite minerals Notes: Sample B3 The Canadian Mineralogist, 2013, 51, 653-662 |
9017176 | CIF | Ca0.2 Fe1.22 Mg0.24 Mn1.33 O8 P2 Zn0.01 | P 1 21/c 1 | 8.775; 11.437; 6.133 90; 99.192; 90 | 607.602 | Tait, K. T.; Hawthorne, F. C.; Wise, M. A. The crystal chemistry of the graftonite-beusite minerals Notes: Sample B4 The Canadian Mineralogist, 2013, 51, 653-662 |
9017177 | CIF | Ca0.58 Fe1.65 Mg0.15 Mn0.61 O8 P2 Zn0.01 | P 1 21/c 1 | 8.7994; 11.5702; 6.1365 90; 99.192; 90 | 616.739 | Tait, K. T.; Hawthorne, F. C.; Wise, M. A. The crystal chemistry of the graftonite-beusite minerals Notes: Sample B5 The Canadian Mineralogist, 2013, 51, 653-662 |
9017178 | CIF | Ca0.57 Fe1.59 Mg0.02 Mn0.81 O8 P2 Zn0.01 | P 1 21/c 1 | 8.788; 11.583; 6.141 90; 99.3; 90 | 616.885 | Tait, K. T.; Hawthorne, F. C.; Wise, M. A. The crystal chemistry of the graftonite-beusite minerals Notes: Sample B6 The Canadian Mineralogist, 2013, 51, 653-662 |
9017179 | CIF | Ca0.37 Fe1.51 Mg0.11 Mn1.01 O8 P2 | P 1 21/c 1 | 8.8072; 11.5131; 6.1372 90; 99.243; 90 | 614.221 | Tait, K. T.; Hawthorne, F. C.; Wise, M. A. The crystal chemistry of the graftonite-beusite minerals Notes: Sample B7 Note: O7 y-coordinate edited by author The Canadian Mineralogist, 2013, 51, 653-662 |
9017240 | CIF | Cl6 Cu7 O8 Se2 | P 1 21/c 1 | 10.958; 14.483; 10.494 90; 113.61; 90 | 1526.04 | Vergasova, L. P.; Semenova, T. F.; Krivovichev, S. V.; Filatov, S. K.; Zolotarev, A. A.; Ananiev, V. V. Nicksobolevite, Cu7(SeO3)2O2Cl6, a new complex copper oxoselenite chloride from Tolbachik fumaroles, Kamchatka peninsula, Russia European Journal of Mineralogy, 2014, 26, 439-449 |
9017283 | CIF | As1.628 Cu5 H8 O15 P0.372 Zn | P 1 21/c 1 | 12.385; 9.261; 10.77 90; 97.1; 90 | 1225.82 | Krivovichev, S. V.; Zhitova, E. S.; Ismagilova, R. M.; Zolotarev, A. A. Site-selective As-P substitution and hydrogen bonding in the crystal structure of philipsburgite, Cu5Zn((As,P)O4)2(OH)6*H2O Note: T = 100 K Physics and Chemistry of Minerals, 2018, 45, 917-923 |
9017284 | CIF | Fe3 H17 K5 O35 S6 | P 1 21/c 1 | 9.448; 18.3183; 17.9825 90; 92.274; 90 | 3109.8 | Biagioni, C.; Bindi, L.; Mauro, D.; Pasero, M. Crystal-chemistry of sulfates from the Apuan Alps (Tuscany, Italy). IV. Giacovazzoite, K5Fe3+3O(SO4)6(H2O)9*H2O, the natural analogue of the ß-Maus's salt and its dehydration product Note: T = 100 K Physics and Chemistry of Minerals, 2020, 47 |
9017285 | CIF | Fe3 H8 K5 O31.52 S6 | P 1 21/c 1 | 9.3434; 18.1838; 17.7702 90; 96.381; 90 | 3000.43 | Biagioni, C.; Bindi, L.; Mauro, D.; Pasero, M. Crystal-chemistry of sulfates from the Apuan Alps (Tuscany, Italy). IV. Giacovazzoite, K5Fe3+3O(SO4)6(H2O)9*H2O, the natural analogue of the beta-Maus's salt and its dehydration product Note: this is the dehydration product Physics and Chemistry of Minerals, 2020, 47 |
9017296 | CIF | H6 O8 S V | P 1 21/c 1 | 7.411; 7.439; 12.272 90; 108.9; 90 | 640.084 | Theobald, F.; Galy, J. Structure cristalline de VOSO4((H2O)3 Note: polymorph of bobjonesite Acta Crystallographica, Section B, 1973, 29, 2732-2736 |
9017308 | CIF | H Na3 O8 S2 | P 1 21/c 1 | 8.648; 9.648; 9.143 90; 108.77; 90 | 722.284 | Catti, M.; Ferraris, G.; Ivaldi, G. A very short, and asymmetrical, hydrogen bond in the structure of Na3H(SO4)2 and S-OH vs O-H...O correlation Acta Crystallographica, Section B, 1979, 35, 525-529 |
9017463 | CIF | As0.79 Cr Cu H O9 P0.21 Pb2 | P 1 21/c 1 | 8.09015; 5.90913; 17.4839 90; 109.99; 90 | 785.474 | Ksenofontov, D. A.; Kabalov, Y. K.; Pekov, I. V.; Zubkova, N. V.; Ekimenkova, I. A.; Pushcharovskii, D. Y. Refinement of the crystal structure of fornacite using the Rietveld method Doklady Earth Sciences, 2014, 456, 520-523 |
9017470 | CIF | Ca Mg O6 Si2 | P 1 21/c 1 | 9.053; 7.677; 4.751 90; 96.34; 90 | 328.175 | Plonka, A. M.; Dera, P.; Irmen, P.; Rivers, M. L.; Ehm, L.; Parise, J. B. Beta-diopside, a new ultrahigh-pressure polymorph of CaMgSi2O6 with six-coordinated silicon Note: P = 56.1 GPa Geophysical Research Letters, 2012, 39, L24307-4 |
9017479 | CIF | C3 H9.3 Ce O10.65 | P 1 21/c 1 | 11.347; 9.63; 10.392 90; 114.52; 90 | 1033.14 | Ollendorff, W.; Weigel, F. The crystal structure of some lanthanide oxalate decahydrates, Ln2(C2O4)3*10H2O, with Ln = La, Ce, Pr, and Nd Inorganic and Nuclear Chemistry Letters, 1969, 5, 263-269 |
9017502 | CIF | Fe3 O8 P2 | P 1 21/c 1 | 6.0186; 4.7768; 10.4192 90; 90.952; 90 | 299.507 | Warner, J. K.; Cheetham, A. K.; Nord, A. G.; Von Dreele, R. B.; Yethiraj, M. Magnetic structure of iron(II) phosphate, sarcopside, Fe3(PO4)2 Sample: FE3(PO4)2 Note: T = 59.7 K Journal of Materials Chemistry, 1992, 2, 191-196 |
9017503 | CIF | Fe3 O8 P2 | P 1 21/c 1 | 6.01037; 4.7727; 10.4052 90; 90.944; 90 | 298.44 | Warner, J. K.; Cheetham, A. K.; Nord, A. G.; Von Dreele, R. B.; Yethiraj, M. Magnetic structure of iron(II) phosphate, sarcopside, Fe3(PO4)2 Sample: FE3(PO4)2 Note: T = 10.1 K Journal of Materials Chemistry, 1992, 2, 191-196 |
9017586 | CIF | Cr0.06 H O6 Ti2 V0.94 | P 1 21/c 1 | 8.4787; 4.5624; 10.033 90; 93.174; 90 | 387.513 | Armbruster, T.; Lazic, B.; Reznitsky, L. Z.; Sklyarov, E. V. Kyzylkumite, Ti2V3+O5(OH): new structure type, modularity and revised formula Mineralogical Magazine, 2013, 77, 33-44 |
9017587 | CIF | Fe0.26 H1.25 O4 Ti1.47 | P 1 21/c 1 | 7.537; 4.5795; 9.885 90; 131.02; 90 | 257.419 | Grey, I. E.; Steinike, K.; MacRae, C. M. Kleberite, Fe3+Ti6O11(OH)5, a new ilmenite alteration product, from Konigshain, northeast Germany Mineralogical Magazine, 2013, 77, 45-55 |
9017592 | CIF | B2 Ca2 O5 | P 1 21/c 1 | 3.5485; 6.352; 19.254 90; 92.393; 90 | 433.608 | Kusachi, I.; Kobayashi, S.; Takechi, Y.; Nakamuta, Y.; Nagase, T.; Yokoyama, K.; Momma, K.; Miyawaki, R.; Shigeoka, M.; Matsubara, S. Shimazakiite-4M and shimazakiite-4O, Ca2B2O5, two polytypes of a new mineral from Fuka, Okayama Prefecture, Japan Note: polytype Shimazakiite-4M Mineralogical Magazine, 2013, 77, 93-105 |
9017631 | CIF | As5.56 S10 Sb0.44 Tl2 | P 1 21/c 1 | 8.013; 24.829; 11.762 90; 132.84; 90 | 1715.9 | Bindi, L.; Nestola, F.; Makovicky, E.; Guastoni, A.; De Battisti, L. Tl-bearing sulfosalt from the Lengenbach quarry, Binn Valley, Switzerland: Philrothite, TlAs3S5 Mineralogical Magazine, 2014, 78, 1-9 |
9017653 | CIF | Ca H2 O4 Se | P 1 21/c 1 | 7.6502; 6.7473; 7.9358 90; 108.542; 90 | 388.368 | Kasatkin, A. V.; Plasil, J.; Marty, J.; Agakhanov, A. A.; Belakovskiy, D. I.; Lykova, I. S. Nestolaite, CaSeO3*H2O, a new mineral from the Little Eva mine, Grand County, Utah, USA Mineralogical Magazine, 2014, 78, 497-505 |
9017658 | CIF | Al0.01 Ca0.13 H7 Na0.73 Nb1.96 O9 Si0.02 Ti0.02 | P 1 21/c 1 | 10.119; 6.436; 12.682 90; 99.91; 90 | 813.603 | Haring, M. M. M.; McDonald, A. M. Franconite, NaNb2O5(OH)*3H2O: structure determination and the role of H bonding, with comments on the crystal chemistry of franconite-related minerals Mineralogical Magazine, 2014, 78, 591-607 |
9017712 | CIF | Ca0.98 Fe1.39 Mg0.05 Mn0.58 O8 P2 | P 1 21/c 1 | 8.792; 11.743; 6.169 90; 99.35; 90 | 628.453 | Pieczka, A.; Hawthorne, F. C.; Ball, N.; Abdu, Y.; Golebiowska, B.; Wlodek, A.; Zukrowski, J. Graftonite-(Mn), ideally M1MnM2,M3Fe2(PO4)2, and graftonite-(Ca), ideally M1CaM2,M3Fe2(PO4)2, two new minerals of the graftonite group from Poland Mineralogical Magazine, 2018, 82, 1307-1322 |
9017713 | CIF | Ca0.3 Fe1.34 Mg0.06 Mn1.3 O8 P2 | P 1 21/c 1 | 8.811; 11.494; 6.138 90; 99.23; 90 | 613.569 | Pieczka, A.; Hawthorne, F. C.; Ball, N.; Abdu, Y.; Golebiowska, B.; Wlodek, A.; Zukrowski, J. Graftonite-(Mn), ideally M1MnM2,M3Fe2(PO4)2, and graftonite-(Ca), ideally M1CaM2,M3Fe2(PO4)2, two new minerals of the graftonite group from Poland Mineralogical Magazine, 2018, 82, 1307-1322 |
9017714 | CIF | Ca0.94 Fe0.92 Mn1.14 O8 P2 | P 1 21/c 1 | 8.799; 11.724; 6.17 90; 99.23; 90 | 628.253 | Hawthorne, F. C.; Wise, M. A.; Cerny, P.; Abdu, Y. A.; Ball, N. A.; Pieczka, A.; Wlodek, A. Beusite-(Ca), ideally CaMn22+(PO4)2, a new graftonite-group mineral from the Yellowknife pegmatite field, Northwest Territories, Canada: Description and crystal structure Mineralogical Magazine, 2018, 82, 1323-1332 |
9017722 | CIF | Ca0.47 Cu0.883 K0.1 Mg0.117 Na4.96 O16 S4 | P 1 21/c 1 | 12.6153; 9.0264; 12.7166 90; 108.311; 90 | 1374.73 | Filatov, S. K.; Shablinskii, A. P.; Krivovichev, S. V.; Vergasova, L. P.; Moskaleva, S. V. Petrovite, Na10CaCu2(SO4)8, a new fumarolic sulfate from the Great Tolbachik fissure eruption, Kamchatka Peninsula, Russia Mineralogical Magazine, 2020, 84, 691-698 |
9017784 | CIF | Cu4 H18 Mg0.672 O20 S2 Zn0.328 | P 1 21/c 1 | 5.6062; 6.1294; 23.834 90; 95.29; 90 | 815.511 | Schluter, J.; Malcherek, T.; Mihailova, B.; Rewitzer, C.; Hochleitner, R.; Muller, D.; Gunther, A. Fehrite, MgCu4(SO4)2(OH)6*6H2O, the magnesium analogue of ktenasite from the Casualidad mine near Banos de Alhamilla, Almeria, Spain Neues Jahrbuch fur Mineralogie, Abhandlungen, 2021, 197, 1-10 |
9017797 | CIF | As0.926 Bi2 H O6 P0.074 | P 1 21/c 1 | 7.001; 7.432; 10.835 90; 107.06; 90 | 538.954 | Mereiter, K.; Preisinger, A. Kristallstrukturdaten der Wismutminerale Atelestit, Mixit und Pucherit Note: structure determined after the paper was published Oesterreische Akademie der Wissenschaften, Mathematich-Naturwissenschaftliche Klasse, Sitzungsberichte, 1986, 123, 79-81 |
9017799 | CIF | Fe0.925 H14 Mg0.075 O11 S | P 1 21/c 1 | 14.0751; 6.5014; 11.0426 90; 105.632; 90 | 973.109 | Mauro, D.; Biagioni, C.; Pasero, M. Crystal-chemistry of sulfates from Apuan Alps (Tuscany, Italy). I. Crystal structure and hydrogen bond system of melanterite, Fe(H2O)6(SO4)*H2O Periodico di Mineralogia, 2018, 87, 89-96 |
9017813 | CIF | C H12 Ca2 Mg3 Na O21 P3 | P 1 21/c 1 | 6.4784; 12.2313; 21.3494 90; 89.624; 90 | 1691.67 | Krivovichev, S. V.; Chernyatieva, A. P.; Britvin, S. N.; Yakovenchuk, V. N. The crystal structure of girvasite, NaCa2Mg3(PO4)3(CO3)(H2O)6, a complex phosphate-carbonate hydrate based upon electroneutral heteropolyhedral layers Note: T = 173 K Russian Geology and Geophysics, 2015, 56, 155-163 |
9017874 | CIF | Ba0.946 Be4 Ca0.954 H11.684 O21.559 P4 | P 1 21/c 1 | 9.4958; 13.6758; 13.4696 90; 90.398; 90 | 1749.16 | Hatert, F.; Dal Bo, F.; Bruni, Y.; Meisser, N.; Vignola, P.; Risplendente, A.; Chatenet, F. X.; Lebocey, J. Limousinite, BaCa[Be4P4O16]*6H2O, a new beryllophosphate mineral with a phillipsite-type framework The Canadian Mineralogist, 2020, 58, 815-827 |
9017905 | CIF | C4 H6 N4 O3 | P 1 21/c 1 | 8.0004; 5.1487; 14.7501 90; 92.908; 90 | 606.799 | Xu, B.; Sung, C.; Han, B. Crystal structure characterization of natural allantoin from edible lichen Umbilicaria esculenta Note: T = 232 K Crystals, 2011, 1, 128-135 |
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