Crystallography Open Database
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Searching space group like 'P b c a'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9017370 | CIF | O3 Se Zn | P b c a | 7.188; 6.225; 11.976 90; 90; 90 | 535.87 | Bensch, W.; Gunther, J. R. The crystal structure of beta-zinc selenite Zeitschrift fur Kristallographie, 1986, 174, 291-295 |
| 9016945 | CIF | Fe0.296 Mg0.704 O3 Si | P b c a | 18.3022; 8.8816; 5.2082 90; 90; 90 | 846.608 | Jacob, D.; Palatinus, L.; Cuvillier, P.; Leroux, H.; Domeneghetti, C.; Camara, F. Ordering state in orthopyroxene as determined by precession electron diffraction American Mineralogist, 2013, 98, 1526-1534 |
| 9016944 | CIF | Fe0.292 Mg0.709 O3 Si | P b c a | 18.281; 8.8732; 5.207 90; 90; 90 | 844.633 | Jacob, D.; Palatinus, L.; Cuvillier, P.; Leroux, H.; Domeneghetti, C.; Camara, F. Ordering state in orthopyroxene as determined by precession electron diffraction American Mineralogist, 2013, 98, 1526-1534 |
| 9016943 | CIF | Fe0.296 Mg0.704 O3 Si | P b c a | 18.3022; 8.8816; 5.2082 90; 90; 90 | 846.608 | Jacob, D.; Palatinus, L.; Cuvillier, P.; Leroux, H.; Domeneghetti, C.; Camara, F. Ordering state in orthopyroxene as determined by precession electron diffraction American Mineralogist, 2013, 98, 1526-1534 |
| 9016942 | CIF | Fe0.292 Mg0.709 O3 Si | P b c a | 18.281; 8.8732; 5.207 90; 90; 90 | 844.633 | Jacob, D.; Palatinus, L.; Cuvillier, P.; Leroux, H.; Domeneghetti, C.; Camara, F. Ordering state in orthopyroxene as determined by precession electron diffraction American Mineralogist, 2013, 98, 1526-1534 |
| 9016572 | CIF | Fe0.087 Mg0.913 O3 Si | P b c a | 17.868; 8.491; 5.0565 90; 90; 90 | 767.158 | Zhang, J. S.; Dera, P.; Bass, J. D. A new high-pressure phase transition in natural Fe-bearing orthoenstatite Note: P = 12.66 GPa American Mineralogist, 2012, 97, 1070-1074 |
| 9016265 | CIF | Mg O3 Si | P b c a | 17.897; 8.575; 5.0664 90; 90; 90 | 777.524 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 9.36(5) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9016257 | CIF | Mg O3 Si | P b c a | 18.019; 8.668; 5.1073 90; 90; 90 | 797.703 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 5.21(7) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9016197 | CIF | O6 P Rb V | P b c a | 6.8182; 9.291; 17.631 90; 90; 90 | 1116.89 | Amoros, P.; Beltran-Porter D; Le Bail, A.; Ferey, G.; Villeneuve, G. Crystal structure of A(VO2)(HPO4)(A=NH4,K,Rb) solved from X-ray powder diffraction _cod_database_code 1000081 European Journal of Solid State and Inorganic Chemistry, 1988, 25, 599-607 |
| 9016153 | CIF | Mg O3 Si | P b c a | 18.105; 8.734; 5.1376 90; 90; 90 | 812.404 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 2.69(5) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9016052 | CIF | Mg O3 Si | P b c a | 18.056; 8.692; 5.1192 90; 90; 90 | 803.421 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 4.19(4) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9015809 | CIF | Mg O3 Si | P b c a | 18.204; 8.81; 5.1731 90; 90; 90 | 829.648 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 0.22(3) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9015700 | CIF | Ca2 O16 Ti2 Zr5 | P b c a | 15.207; 15.207; 10.114 90; 90; 90 | 2338.89 | Callegari, A.; Mazzi, F.; Ungaretti, P. The crystal structure of orthorhombic calzirtite from Val Malenco (Italy) Note: crystal n.2 Neues Jahrbuch fur Mineralogie, Monatshefte, 1997, 1997, 467-480 |
| 9015441 | CIF | N O6 P V | P b c a | 6.8064; 9.2567; 17.732 90; 90; 90 | 1117.2 | Amoros, P.; Beltran-Porter D; Le Bail, A.; Ferey, G.; Villeneuve, G. Crystal structure of A(VO2)(HPO4)(A=NH4,K,Rb) solved from X-ray powder diffraction _cod_database_code 1000080 European Journal of Solid State and Inorganic Chemistry, 1988, 25, 599-607 |
| 9014983 | CIF | Mg O3 Si | P b c a | 17.933; 8.595; 5.0766 90; 90; 90 | 782.477 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 8.26(6) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9014942 | CIF | Ni P | P b c a | 6.036; 4.8684; 6.8788 90; 90; 90 | 202.138 | Dera, P.; Lazarz, J. D.; Lavina, B. Pressure-induced development of bonding in NiAs type compounds and polymorphism of NiP Note: P = 1.29 GPa Journal of Solid State Chemistry, 2011, 184, 1997-2003 |
| 9014860 | CIF | Mg O3 Si | P b c a | 18.158; 8.78; 5.1574 90; 90; 90 | 822.23 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 1.23(4) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9014665 | CIF | H7 Mg O7 P | P b c a | 10.215; 10.681; 10.014 90; 90; 90 | 1092.59 | Sutor, D. J. The crystal and molecular structure of newberyite, MgHPO4*3H2O Acta Crystallographica, 1967, 23, 418-422 |
| 9014644 | CIF | B Be2 F0.04 H0.96 O3.96 | P b c a | 9.762; 12.201; 4.43 90; 90; 90 | 527.64 | Gatta, G. D.; McIntyre, G. J.; Bromiley, G.; Guastoni, A.; Nestola, F. A single-crystal neutron diffraction study of hambergite, Be2BO3(OH,F) American Mineralogist, 2012, 97, 1891-1897 |
| 9014535 | CIF | Mg O3 Si | P b c a | 17.982; 8.633; 5.0926 90; 90; 90 | 790.568 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 6.57(5) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9014505 | CIF | O3 Ti1.67 | P b c a | 9.781; 9.778; 9.815 90; 90; 90 | 938.693 | Ma, C.; Tschauner, O.; Beckett, J. R.; Rossman, G. R.; Liu, W. Panguite, (Ti4+,Sc,Al,Mg,Zr,Ca)1.8O3, a new ultra-refractory titania mineral from the Allende meteorite: Synchrotron micro-diffraction and EBSD American Mineralogist, 2012, 97, 1219-1225 |
| 9014447 | CIF | Mg O3 Si | P b c a | 17.916; 8.59; 5.0726 90; 90; 90 | 780.665 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 8.65(7) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9014308 | CIF | Al6 Ca8.5 Na O18 | P b c a | 10.875; 10.859; 15.105 90; 90; 90 | 1783.77 | Nishi, F.; Takeuchi, Y. The Al6O18 rings of tetrahedra in the structure of Ca8.5NaAl6O18 Acta Crystallographica, Section B, 1975, 31, 1169-1173 |
| 9014117 | CIF | Mg O3 Si | P b c a | 18.21; 8.82; 5.1767 90; 90; 90 | 831.441 | Periotto, B.; Balic-Zunic T; Nestola, F.; Katerinopoulou, A.; Angel, R. J. Re-investigation of the crystal structure of enstatite under high-pressure conditions Note: P = 0.00010(1) GPa American Mineralogist, 2012, 97, 1741-1748 |
| 9014107 | CIF | H7 Mg2 Na O11 P2 | P b c a | 16.295; 13.009; 8.434 90; 90; 90 | 1787.85 | Atencio, D.; Chukanov, N. V.; Nestola, F.; Witzke, T.; Coutinho, J. M. V.; Zadov, A. E.; Contreira, R. R.; Farber, G. Mejillonesite, a new acid sodium, magnesium phosphate mineral, from Mejillones, Antofagasta, Chile American Mineralogist, 2012, 97, 19-25 |
| 9012410 | CIF | As2 Ni | P b c a | 5.77; 5.838; 11.419 90; 90; 90 | 384.652 | Stassen, W. N.; Heyding, R. D. Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2 Canadian Journal of Chemistry, 1968, 46, 2159-2163 |
| 9012373 | CIF | Ca Mn2 O4 | P b c a | 6.2545; 9.8995; 9.627 90; 90; 90 | 596.069 | Zouari, S.; Ranno, L.; Cheikh-Rouhou A; Isnard, O.; Pernet, M.; Wolfers, P.; Strobel, P. New model for the magnetic structure of the marokite-type oxide CaMn2O4 Note: reported bond lengths are inconsistent with reported structure Sample: T = 1.5 K Journal of Alloys and Compounds, 2003, 353, 5-11 |
| 9012212 | CIF | H4 In O6 P | P b c a | 8.842; 10.187; 10.327 90; 90; 90 | 930.189 | Xu, Y.; Koh, L. L.; An, L. H.; Xu, R. R.; Qiu, S. L. A comparative study of a novel microporous indiumphosphate and other M(III)X(V)O4-type microporous materials Journal of Solid State Chemistry, 1995, 117, 373-378 |
| 9011832 | CIF | Ca1.14 Fe0.01 H2 Mn0.84 O5 Si | P b c a | 9.249; 9.076; 10.342 90; 90; 90 | 868.148 | Bonazzi, P.; Bindi, L.; Medenbach, O.; Pagano, R.; Lampronti, G. I.; Menchetti, S. Olmiite, CaMn[SiO3(OH)](OH), the Mn-dominant analogue of poldervaartite, a new mineral species from Kalahari manganese fields (Republic of South Africa) Mineralogical Magazine, 2007, 71, 193-201 |
| 9011804 | CIF | C2 H2 O12 Pb4 S | P b c a | 9.242; 23.05; 10.383 90; 90; 90 | 2211.87 | Steele, I. M.; Pluth, J. J.; Livingstone, A. Crystal structure of macphersonite (Pb4SO4(CO3)2(OH)2): comparison with leadhillite Locality: Leadhills-Wanlockhead orefield, Scotland Note: space group changed from Pcab to Pbca Mineralogical Magazine, 1998, 62, 451-459 |
| 9011505 | CIF | As4.782 Pb S9 Sb0.218 Tl | P b c a | 10.786; 35.389; 8.141 90; 90; 90 | 3107.47 | Matsushita, Y.; Takeuchi, Y. Refinement of the crystal structure of hutchinsonite, TlPbAs5S9 Zeitschrift fur Kristallographie, 1994, 209, 475-478 |
| 9011378 | CIF | Ca2 H2 O5 Si | P b c a | 9.487; 9.179; 10.666 90; 90; 90 | 928.808 | Marsh, R. E. A revised structure for alpha-dicalcium silicate hydrate Acta Crystallographica, Section C, 1994, 50, 996-997 |
| 9011179 | CIF | H5 Na2 O6 P | P b c a | 16.872; 10.359; 6.599 90; 90; 90 | 1153.35 | Catti, M.; Ferraris, G.; Franchini-Angela M The crystal structure of Na2HPO4*2H2O. Competition between coordination and hydrogen bonds Locality: synthetic Note: displacement parameters from ICSD, Biso(H1) invented Acta Crystallographica, Section B, 1977, 33, 3449-3452 |
| 9011166 | CIF | H K O4 S | P b c a | 8.429; 9.807; 18.976 90; 90; 90 | 1568.62 | Payan, F.; Haser, R. On the hydrogen bonding in potassium hydrogen sulphate. Comparison with a previous crystal structure determination Acta Crystallographica, Section B, 1976, 32, 1875-1879 |
| 9011157 | CIF | Cu2.5 Fe0.5 S2 | P b c a | 10.95; 21.862; 10.95 90; 90; 90 | 2621.31 | Koto, K.; Morimoto, N. Superstructure investigation of bornite, Cu5FeS4, by the modified partial Patterson function Acta Crystallographica, Section B, 1975, 31, 2268-2273 |
| 9011152 | CIF | H K O4 S | P b c a | 8.412; 9.8; 18.957 90; 90; 90 | 1562.77 | Cotton, F. A.; Frenz, B. A.; Hunter, D. L. The structure of potassium hydrogensulfate Note: y(O23), z(H1), x(H2) corrected Acta Crystallographica, Section B, 1975, 31, 302-304 |
| 9011045 | CIF | H4 In O6 P | P b c a | 10.36; 8.84; 10.19 90; 90; 90 | 933.225 | Mooney-Slater R C L X-ray diffraction study of indium phosphate dihydrate and isostructural thallic compounds Acta Crystallographica, 1961, 14, 1140-1146 |
| 9011017 | CIF | H K O4 S | P b c a | 8.4; 9.79; 18.93 90; 90; 90 | 1556.73 | Loopstra, L. H.; MacGillavry, V. H. The crystal structure of KHSO4 (mercallite) Acta Crystallographica, 1958, 11, 349-354 |
| 9010973 | CIF | Ca2 O5 Si | P b c a | 9.34; 9.22; 10.61 90; 90; 90 | 913.678 | Heller, L. The structure of dicalcium silicate alpha-hydrate Acta Crystallographica, 1952, 5, 724-728 |
| 9010898 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.2513; 8.8274; 5.1929 90; 90; 90 | 836.636 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 150 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010897 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.3995; 8.9329; 5.2519 90; 90; 90 | 863.207 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 975 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010896 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4047; 8.9366; 5.2543 90; 90; 90 | 864.203 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,000 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010895 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4125; 8.9408; 5.2577 90; 90; 90 | 865.536 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,025 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010894 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4197; 8.9449; 5.2609 90; 90; 90 | 866.798 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,050 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010893 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4244; 8.9481; 5.2639 90; 90; 90 | 867.824 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,075 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010892 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4314; 8.952; 5.2674 90; 90; 90 | 869.11 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,100 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010891 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4378; 8.9555; 5.2711 90; 90; 90 | 870.363 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,125 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010890 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.445; 8.9589; 5.2749 90; 90; 90 | 871.661 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,150 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010889 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4517; 8.9612; 5.2797 90; 90; 90 | 872.995 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,175 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010888 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.4588; 8.9638; 5.2848 90; 90; 90 | 874.428 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 1,200 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010887 | CIF | Al0.03 Fe0.15 Mg1.82 O6 Si1.97 | P b c a | 18.2429; 8.8171; 5.1894 90; 90; 90 | 834.712 | Gatta, G. D.; Rinaldi, R.; Knight, K. S.; Molin, G.; Artioli, G. High temperature structural and thermoelastic behaviour of mantle orthopyroxene: an in situ neutron powder diffraction study Sample: T = 20 C Physics and Chemistry of Minerals, 2007, 34, 185-200 |
| 9010873 | CIF | Fe0.47 Li0.2 Mg1.33 O6 Si2 | P b c a | 18.2162; 8.8194; 5.2054 90; 90; 90 | 836.279 | Camara, F.; Iezzi, G.; Tiepolo, M.; Oberti, R. The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene Sample: LMFPX5 Physics and Chemistry of Minerals, 2006, 33, 475-483 |
| 9010872 | CIF | Fe0.47 Li0.2 Mg1.33 O6 Si2 | P b c a | 18.2369; 8.8246; 5.2076 90; 90; 90 | 838.077 | Camara, F.; Iezzi, G.; Tiepolo, M.; Oberti, R. The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene Sample: LMFPX4 Physics and Chemistry of Minerals, 2006, 33, 475-483 |
| 9010871 | CIF | Fe0.47 Li0.2 Mg1.33 O6 Si2 | P b c a | 18.2113; 8.8172; 5.205 90; 90; 90 | 835.781 | Camara, F.; Iezzi, G.; Tiepolo, M.; Oberti, R. The crstal chemistry of lithium and Fe3+ in synthetic orthopyroxene Sample: LMFPX3 Physics and Chemistry of Minerals, 2006, 33, 475-483 |
| 9010721 | CIF | B2 Ca Mg O5 | P b c a | 36.34; 11.135; 5.499 90; 90; 90 | 2225.15 | Callegari, A.; Mazzi, F.; Tadini, C. Modular aspects of the crystal structures of kurchatovite and clinokurchatovite Locality: Solongo, Siberia European Journal of Mineralogy, 2003, 15, 277-282 |
| 9010617 | CIF | Ca2 Fe3.254 H4 Mg2.746 Na0.478 O26 P6 | P b c a | 12.4595; 11.5955; 12.7504 90; 90; 90 | 1842.1 | Grew, E. S.; Armbruster, T.; Medenbach, O.; Yates, M. G.; Carson, C. J. Tassieite, (Na,_)Ca2(Mg,Fe2+,Fe3+)2(Fe3+,Mg)2(Fe2+,Mg)2(PO4)6*2H2O, a new hydrothermal wicksite-group mineral in fluorapatite nodules from granulite- facies paragneiss in the Larsemann Hills, Prydz Bay, East Antarctica Sample: 1 The Canadian Mineralogist, 2007, 45, 293-305 |
| 9010616 | CIF | Ca2 Fe3.314 H4 Mg2.686 Na0.463 O26 P6 | P b c a | 12.4595; 11.5955; 12.7504 90; 90; 90 | 1842.1 | Grew, E. S.; Armbruster, T.; Medenbach, O.; Yates, M. G.; Carson, C. J. Tassieite, (Na,_)Ca2(Mg,Fe2+,Fe3+)2(Fe3+,Mg)2(Fe2+,Mg)2(PO4)6*2H2O, a new hydrothermal wicksite-group mineral in fluorapatite nodules from granulite- facies paragneiss in the Larsemann Hills, Prydz Bay, East Antarctica Sample: 2 The Canadian Mineralogist, 2007, 45, 293-305 |
| 9010610 | CIF | H2 O10 S Sn6.54 | P b c a | 14.0071; 12.5016; 14.503 90; 90; 90 | 2539.64 | Locock, A. J.; Ramik, R. A.; Back, M. E. The structures of two novel Sn2+ oxysalts found with romarchite and hydroromarchite as corrosion products of pewter artifacts The Canadian Mineralogist, 2006, 44, 1457-1467 |
| 9010430 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 17.977; 8.61; 5.1227 90; 90; 90 | 792.902 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 9.562 GPa American Mineralogist, 2008, 93, 644-652 |
| 9010429 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.0221; 8.6456; 5.1327 90; 90; 90 | 799.736 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 8.033 GPa American Mineralogist, 2008, 93, 644-652 |
| 9010428 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.1427; 8.746; 5.1716 90; 90; 90 | 820.609 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 3.947 GPa American Mineralogist, 2008, 93, 644-652 |
| 9010427 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2192; 8.8111; 5.1965 90; 90; 90 | 834.2 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 1.715 GPa American Mineralogist, 2008, 93, 644-652 |
| 9010426 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2804; 8.8601; 5.2161 90; 90; 90 | 844.832 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 0.163 GPa American Mineralogist, 2008, 93, 644-652 |
| 9010425 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2889; 8.8662; 5.2175 90; 90; 90 | 846.034 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 0 GPa, in air, same # of reflections as DAC crystal American Mineralogist, 2008, 93, 644-652 |
| 9010424 | CIF | Al0.236 Ca0.01 Fe0.967 Mg0.923 Mn0.016 O6 Si1.848 | P b c a | 18.2889; 8.8662; 5.2175 90; 90; 90 | 846.034 | Nestola, F.; Ballaran, T. B.; Balic-Zunic T; Secco, L.; Dal Negro, A. The high-pressure behavior of an Al- and Fe-rich natural orthopyroxene Sample: P = 0 GPa, in air American Mineralogist, 2008, 93, 644-652 |
| 9010241 | CIF | Al0.23 Mg0.874 O3 Si0.875 | P b c a | 18.1876; 8.7352; 5.1789 90; 90; 90 | 822.784 | Smyth, J. R.; Mierdel, K.; Keppler, H.; Langenhorst, F.; Dubrovinsky, L.; Nestola, F. Crystal chemistry of hydration in aluminous orthopyroxene American Mineralogist, 2007, 92, 973-976 |
| 9010154 | CIF | Li0.52 Mg0.96 O6 Sc0.52 Si2 | P b c a | 18.259; 8.883; 5.271 90; 90; 90 | 854.928 | Yang, H.; Downs, R. T. Synthesis and crystal structure of Li0.52Mg0.96Sc0.52Si2O6 orthopyroxene American Mineralogist, 2007, 92, 225-228 |
| 9010007 | CIF | Fe H4 O6 P | P b c a | 8.722; 9.878; 10.1187 90; 90; 90 | 871.786 | Taxer, K.; Bartl, H. On the dimorphy between the variscite and clinovariscite group: refined finestructural relationship of strengite and clinostrengite, Fe(PO4)*2H2O Note: x(O3) corrected to match reported bond lengths Crystal Research and Technology, 2004, 39, 1080-1088 |
| 9009834 | CIF | Cu3 H3 O7 P | P b c a | 10.854; 14.053; 7.086 90; 90; 90 | 1080.84 | Eby, R. K.; Hawthorne, F. C. Cornetite: modulated densely-packed Cu2+ oxysalt Mineralogy and Petrology, 1989, 40, 127-136 |
| 9009617 | CIF | H7 Mg O7 P | P b c a | 10.203; 10.678; 10.015 90; 90; 90 | 1091.11 | Bartl, H.; Catti, M.; Joswig, W.; Ferraris, G. Investigation of the crystal structure of newberyite, MgHPO4*3H2O, by single crystal neutron diffraction Tschermaks Mineralogische und Petrographische Mitteilungen, 1983, 32, 187-194 |
| 9009087 | CIF | O2 Ti | P b c a | 9.184; 5.447; 5.145 90; 90; 90 | 257.38 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
| 9008882 | CIF | Sb Zn | P b c a | 6.218; 7.741; 8.115 90; 90; 90 | 390.604 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 85-237 |
| 9008881 | CIF | Cd Sb | P b c a | 6.471; 8.253; 8.526 90; 90; 90 | 455.332 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 85-237 |
| 9008434 | CIF | Al0.14 F0.8 Fe1.78 H23.2 K0.32 Mg0.08 Mn1.5 O32.76 P4 Ti1.56 | P b c a | 10.561; 20.585; 12.516 90; 90; 90 | 2720.96 | Demartin, F.; Pilati, T.; Gay, H. D.; Gramaccioli, C. M. The crystal structure of a mineral related to paulkerrite Zeitschrift fur Kristallographie, 1993, 208, 57-71 |
| 9008180 | CIF | Ge Mn O3 | P b c a | 19.267; 9.248; 5.477 90; 90; 90 | 975.899 | Fang, J. H.; Townes, W. D.; Robinson, P. D. The crystal structure of manganese metagermanate, MnGeO3 Note: x coordinate of O6 altered to a reasonable value Zeitschrift fur Kristallographie, 1969, 130, 139-147 |
| 9008164 | CIF | Mg O3 Si | P b c a | 18.21; 8.812; 5.178 90; 90; 90 | 830.896 | Morimoto, N.; Koto, K. The crystal structure of orthoenstatite Zeitschrift fur Kristallographie, 1969, 129, 65-83 |
| 9008163 | CIF | I2 Sr | P b c a | 15.22; 8.22; 7.9 90; 90; 90 | 988.356 | 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 |
| 9008125 | CIF | O2 Te | P b c a | 12.035; 5.464; 5.607 90; 90; 90 | 368.712 | Beyer, H. Verfeinerung der kristallstruktur von tellurit, dem rhomischen TeO2 Zeitschrift fur Kristallographie, 1967, 124, 228-237 |
| 9008108 | CIF | As5 Pb S9 Tl | P b c a | 10.81; 35.36; 8.16 90; 90; 90 | 3119.09 | Takeuchi, Y.; Ghose, S.; Nowacki, W. The crystal structure of hutchinsonite, (Tl,Pb)2As5S9 Zeitschrift fur Kristallographie, 1965, 121, 321-348 |
| 9007957 | CIF | Cr3 Cs2 O10 | P b c a | 11.887; 9.671; 19.493 90; 90; 90 | 2240.9 | Kolitsch, U. alpha-Cs2Cr3O10 Acta Crystallographica, Section E, 2003, 59, i164-i166 |
| 9007943 | CIF | B4 Hg O7 | P b c a | 8.3994; 8.8066; 14.137 90; 90; 90 | 1045.72 | Weil, M. HgB4O7, a member of the isotypic MIIB4O7 family (MII = Mg, Mn, Zn, Cd) Acta Crystallographica, Section E, 2003, 59, i40-i42 |
| 9007941 | CIF | H8 Mg Na O10 P3 | P b c a | 14.806; 9.078; 14.811 90; 90; 90 | 1990.73 | Ouarsal, R.; Tahiri, A. A.; Lachkar, M.; Dusek, M.; Fejfarova, K.; El Bali, B. Sodium magnesium tris(dihydrogenphosphite) monohydrate, NaMg(H2PO3)3*H2O Acta Crystallographica, Section E, 2003, 59, i33-i35 |
| 9007872 | CIF | C12 Li N2 | P b c a | 11.238; 16.014; 14.522 90; 90; 90 | 2613.46 | Hammel, A.; Schwarz, W.; Weidlein, J. (n5-methylcyclopentadienyl)(N,N,N',N'-tetramethylethylenediamine)lithium* Acta Crystallographica, Section C, 1990, 46, 2337-2339 |
| 9007632 | CIF | H7 Mg O7 P | P b c a | 10.203; 10.678; 10.015 90; 90; 90 | 1091.11 | Abbona, F.; Boistelle, R.; Haser, R. Hydrogen bonding in MgHPO4*3H2O (newberyite) Acta Crystallographica, Section B, 1979, 35, 2514-2518 |
| 9007618 | CIF | Al H4 O6 P | P b c a | 9.822; 8.561; 9.63 90; 90; 90 | 809.75 | Kniep, R.; Mootz, D.; Vegas, A. Variscite Acta Crystallographica, Section B, 1977, 33, 263-265 |
| 9007613 | CIF | As H9 Mg O8 | P b c a | 7.472; 10.891; 16.585 90; 90; 90 | 1349.65 | Protas, J.; Gindt, R. Structure cristalline de la brassite, MgHAsO4*4H2O, produit de deshydratation de la roesslerite Locality: synthetic Acta Crystallographica, Section B, 1976, 32, 1460-1466 |
| 9007605 | CIF | As Fe H4 O6 | P b c a | 10.325; 8.953; 10.038 90; 90; 90 | 927.91 | Kitahama, K.; Kiriyama, R.; Yoshihisa, B. Refinement of the crystal structure of scorodite Acta Crystallographica, Section B, 1975, 31, 322-324 |
| 9007548 | CIF | H10 Mg N2 O12 P2 | P b c a | 11.49; 23.66; 8.62 90; 90; 90 | 2343.38 | Khan, A. A.; Baur, W. H. Salt hydrates. VIII. The crystal structures of sodium ammonium orthochromate dihydrate and magnesium diammonium bis(hydrogen orthophosphate) tetrahydrate and a discussion of the ammonium ion Acta Crystallographica, Section B, 1972, 28, 683-693 |
| 9006447 | CIF | Cu0.564 Mg1.436 O6 Si2 | P b c a | 18.221; 8.89; 5.226 90; 90; 90 | 846.532 | Tachi, T.; Horiuchi, H.; Nagasawa, H. Structure of Cu-bearing orthopyroxene, Mg(Cu.56,Mg.44)Si2O6, and behavior of Cu2+ in the orthopyroxene structure Physics and Chemistry of Minerals, 1997, 24, 463-476 |
| 9006442 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18; 8.642; 5.115 90; 90; 90 | 795.669 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 6.01 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006441 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.051; 8.6683; 5.1244 90; 90; 90 | 801.822 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 4.93 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006440 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.077; 8.6907; 5.1349 90; 90; 90 | 806.702 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 4.03 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006439 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.115; 8.7184; 5.1472 90; 90; 90 | 812.917 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 3.00 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006438 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.16; 8.7503; 5.1606 90; 90; 90 | 820.047 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 1.90 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006437 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.189; 8.7765; 5.1723 90; 90; 90 | 825.684 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 1.04 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006436 | CIF | Al0.14 Ca0.012 Fe0.24 Mg1.66 O6 Si1.94 | P b c a | 18.231; 8.8095; 5.1873 90; 90; 90 | 833.111 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 0.00 GPa, natural orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006435 | CIF | Fe0.41 Mg0.59 O3 Si | P b c a | 18.035; 8.682; 5.1138 90; 90; 90 | 800.718 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 7.50 GPa, synthetic En60 orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006434 | CIF | Fe0.41 Mg0.59 O3 Si | P b c a | 18.0665; 8.706; 5.1236 90; 90; 90 | 805.875 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 6.59 GPa, synthetic En60 orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006433 | CIF | Fe0.41 Mg0.59 O3 Si | P b c a | 18.0912; 8.724; 5.1315 90; 90; 90 | 809.892 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 5.77 GPa, synthetic En60 orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
| 9006432 | CIF | Fe0.41 Mg0.59 O3 Si | P b c a | 18.124; 8.754; 5.144 90; 90; 90 | 816.134 | Hugh-Jones D A; Chopelas, A.; Angel, R. J. Tetrahedral compression in (Mg,Fe)SiO3 orthopyroxenes Sample: P = 4.76 GPa, synthetic En60 orthopyroxene Physics and Chemistry of Minerals, 1997, 24, 301-310 |
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