Crystallography Open Database

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9017822 CIFBa K O4 VP n m a7.802; 5.908; 10.376
90; 90; 90
478.274Mugavero, S. J.; Bharathy, M.; McAlum, J.; Loye, H. C.
Crystal growth of alkaline earth vanadates from hydroxide fluxes
Solid State Sciences, 2008, 10, 370-376
9017806 CIFCl Cu2 H3 O3P n m a6.02797; 6.86383; 9.11562
90; 90; 90
377.158Zheng, X. G.; Mori, T.; Nishiyama, K.; Higemoto, W.; Yamada, H.; Nishikubo, K.; Xu, C. N.
Antiferromagnetic transitions in polymorphous minerals of the natural cuprates atacamite and botallackite Cu2Cl(OH)3
Physical Review B - Condensed Matter, 2005, 71, 174404-174408
9017753 CIFFe PP n m a5.099; 3.251; 5.695
90; 90; 90
94.405Britvin, S. N.; Vapnik, Y.; Polekhovsky, Y. S.; Krivovichev, S. V.; Krzhizhanovskaya, M. G.; Gorelova, L. A.; Vereshchagin, O. S.; Shilovskikh, V. V.; Zaitsev, A. N.
Murashkoite, FeP, a new terrestrial phosphide from pyrometamorphic rocks of the Hatrurim Formation, South Levant
Mineralogy and Petrology, 2019, 113, 237-248
9017737 CIFAl6 As3 H33 O33P n m a19.855; 17.6933; 7.7799
90; 90; 90
2733.08Grey, I. E.; Favreau, G.; Mills, S. J.; Mumme, W. G.; Bougerol, C.; Brand, H. E. A.; Kampf, A. R.; MacRae, C. M.; Shanks, F.
Galeaclolusite, [Al6(AsO4)3(OH)9(H2O)4]*8H2O, a new bulachite-related mineral from Cap Garonne, France
Mineralogical Magazine, 2021, 85, 142-148
9017720 CIFAl2 As H7 O9P n m a15.3994; 17.6598; 7.80827
90; 90; 90
2123.46Grey, I. E.; Yoruk, E.; Kodjikian, S.; Klein, H.; Bougerol, C.; Brand, H. E. A.; Bordet, P.; Mumme, W. G.; Favreau, G.; Mills, S. J.
Bulachite, [Al6(AsO4)3(OH)9(H2O)4]*2H2O from Cap Garonne, France: Crystal structure and formation from a higher hydrate Note: T = 100 C
Mineralogical Magazine, 2020, 84, 608-615
9017705 CIFDy0.08 Er0.05 F2.92 Gd0.03 Ho0.02 O0.08 Tb0.01 Tm0.01 Y0.79 Yb0.01P n m a6.3827; 6.86727; 4.39168
90; 90; 90
192.495Atencio, D.; Bastos Neto, A. C.; Pereira, V. P.; Ferron, J. T. M. M.; Hoshino, M.; Moriyama, T.; Watanabe, Y.; Miyawaki, R.; Coutinho, J. M. V.; Andrade, M. B.; Domanik, K.; Chukanov, N. V.; Momma, K.; Hirano, H.; Tsunematsu, M.
Waimirite-(Y), orthorhombic YF3, a new mineral from the Pitinga mine, Presidente Figueiredo, Amazonas, Brazil and from Jabal Tawlah, Saudi Arabia: description and crystal structure
Mineralogical Magazine, 2015, 79, 767-780
9017681 CIFAs2 Cu4 O9P n m a8.2581; 6.4026; 13.8047
90; 90; 90
729.9Pekov, I. V.; Zubkova, N. V.; Yapaskurt, V. O.; Belakovskiy, D. I.; Vigasina, M. F.; Sidorov, E. G.; Pushcharovsky, D. Y.
New arsenate minerals from the Arsenatnaya fumarole, Tolbachik volcano, Kamchatka, Russia. II. Ericlaxmanite and kozyrevskite, two natural modifications of Cu4O(AsO4)2
Mineralogical Magazine, 2014, 78, 1553-1569
9017639 CIFC8 H66 Ca4 Cr8 O69 S SrP n m a15.351; 20.421; 18.27
90; 90; 90
5727.33Elliott, P.; Giester, G.; Rowe, R.; Pring, A.
Putnisite, SrCa4Cr3+8(CO3)8SO4(OH)16*25H2O, a new mineral from Western Australia: description and crystal structure
Mineralogical Magazine, 2014, 78, 131-144
9017629 CIFH I O PbP n m a7.8244; 4.2107; 10.4724
90; 90; 90
345.026Siidra, O. I.; Zenko, D. Y.; Suknotova, A. N.; Krivovichev, S. V.
Crystal structure of a novel synthetic compound, Pb2O(OH)I, and structure refinement of iodolaurionite, Pb(OH)I: hydroxo- and oxocentred units in Pb minerals and synthetic compounds
Mineralogical Magazine, 2013, 77, 3239-3248
9017596 CIFCa0.138 Fe1.68 Mg0.764 Na2.862 O12 Ti3.556P n m a27.714; 2.9881; 11.3564
90; 90; 90
940.449Anashkin, S.; Bovkun, A.; Bindi, L.; Garanin, V.; Litvin, Y.
Kudryavtsevaite, Na3MgFe3+Ti4O12, a new kimberlitic mineral
Mineralogical Magazine, 2013, 77, 327-334
9017546 CIFAl6.54 As0.22 B O17.186 Sb0.62 Si2.186 Ta0.11P n m a4.7264; 11.981; 20.566
90; 90; 90
1164.59Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S.
The crystal chemistry of holtite Sample: H4
Mineralogical Magazine, 2009, 73, 1033-1050
9017545 CIFAl6.374 As0.052 B O17.156 Sb0.792 Si2.156 Ta0.26P n m a4.69; 11.897; 20.385
90; 90; 90
1137.42Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S.
The crystal chemistry of holtite Sample: H3
Mineralogical Magazine, 2009, 73, 1033-1050
9017544 CIFAl6.39 As0.138 B O17.65 Sb0.21 Si2.65 Ta0.23P n m a4.6981; 11.926; 20.413
90; 90; 90
1143.73Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S.
The crystal chemistry of holtite Sample: H2
Mineralogical Magazine, 2009, 73, 1033-1050
9017543 CIFAl6.32 As0.152 B O17.61 Sb0.238 Si2.61 Ta0.32P n m a4.6818; 11.867; 20.302
90; 90; 90
1127.96Groat, L. A.; Grew, E. S.; Evans, R. J.; Pieczka, A.; Ercit, T. S.
The crystal chemistry of holtite Sample: H1
Mineralogical Magazine, 2009, 73, 1033-1050
9017538 CIFAl2 As2 K Na O9P n m a8.2368; 5.5228; 17.016
90; 90; 90
774.061Ben Yahia, H.; Nilges, T.; Rodewald, U. C.; Pottgen, R.
New arsenates (V) NaKAl2O(AsO4)2 and Na2KAl3(AsO4)4
Materials Research Bulletin, 2010, 45, 2017-2023
9017480 CIFBr3 Fe KP n m a8.712; 3.845; 14.15
90; 90; 90
473.992Amit, A.; Horowitz, A.; Makovsky, J.
Preparation and crystal structure of KFeCl3 and KFeBr3
Israel Journal of Chemistry, 1974, 12, 827-830
9017477 CIFAs2 Cu4 O9P n m a8.253; 6.4122; 13.789
90; 90; 90
729.712Adams, R. D.; Layland, R.; Payen, C.
Cu4(AsO4)2(O): A new copper arsenate with unusual low temperature magnetic properties
Inorganic Chemistry, 1995, 34, 5397-5398
9017465 CIFBa Cu2 O7 Si2P n m a6.86317; 13.1773; 6.86317
90; 90; 90
620.692Chen, Y.; Zhang, Y.; Feng, S.
Hydrothermal synthesis and properties of pigments Chinese purple BaCuSi2O6 and dark blue BaCu2Si2O7
Dyes and Pigments, 2014, 105, 167-173
9017395 CIFAs RhP n m a5.62; 3.58; 6
90; 90; 90
120.718Heyding, R. D.; Calvert, L. D.
Arsenides of the transition metals IV. A note on the platinum metal arsenides
Canadian Journal of Chemistry, 1961, 39, 955-957
9017377 CIFF3 YP n m a6.3537; 6.8545; 4.3953
90; 90; 90
191.422Cheetham, A. K.; Norman, N.
The structures of yttrium and bismuth trifluorides by neutron diffraction
Acta Chemica Scandinavica, 1974, 55-60
9017287 CIFBi5 O16 TeP n m a10.61155; 22.74458; 5.399038
90; 90; 90
1303.09Nenert, G.; Missen, O. P.; Lian, H.; Weil, M.; Blake, G. R.; Kampf, A. R.; Mills, S. J.
Crystal structure and thermal behavior of Bi6Te2O15: investigation of synthetic and natural pingguite
Physics and Chemistry of Minerals, 2020, 47
9017286 CIFBi6 O15 Te2P n m a10.637; 22.797; 5.4136
90; 90; 90
1312.75Nenert, G.; Missen, O. P.; Lian, H.; Weil, M.; Blake, G. R.; Kampf, A. R.; Mills, S. J.
Crystal structure and thermal behavior of Bi6Te2O15: investigation of synthetic and natural pingguite
Physics and Chemistry of Minerals, 2020, 47
9017076 CIFCr2 Fe O4P n m a9.0633; 2.95793; 10.6391
90; 90; 90
285.219Ishii, T.; Kojitani, H.; Tsukamoto, S.; Fujino, K.; Mori, D.; Inaguma, Y.; Tsujino, N.; Yoshino, T.; Yamazaki, D.; Higo, Y.; Funakoshi, K.; Akaogi, M.
High-pressure phase transitions in FeCr2O4 and structure analysis of new post- spinel FeCr2O4 and Fe2Cr2O5 phases with meteoritical and petrological implications
American Mineralogist, 2014, 99, 1788-1797
9017058 CIFAl0.015 Ca Cr0.011 Fe1.957 Mg0.003 O4 Ti0.004P n m a9.2183; 3.0175; 10.6934
90; 90; 90
297.45Galuskina, I. O.; Vapnik, Y.; Lazic, B.; Armbruster, T.; Murashko, M.; Galuskin, E. V.
Harmunite CaFe2O4: A new mineral from the Jabel Harmun, West Bank, Palestinian Autonomy, Israel
American Mineralogist, 2014, 99, 965-975
9016899 CIFAl6.692 B O18 Si2.943P n m a4.6882; 11.7924; 20.1856
90; 90; 90
1115.96Evans, R. J.; Fyfe, C. A.; Groat, L. A.; Lam, A. E.
MAS NMR measurements and ab initio calculations of the 29Si chemical shifts in dumortierite and holtite
American Mineralogist, 2012, 97, 329-340
9016795 CIFAl1.89 F0.03 Fe1.71 H3.94 K0.01 Li1.88 Mg1.47 Mn0.01 Na0.04 O23.97 Si8P n m a18.2872; 17.6797; 5.2784
90; 90; 90
1706.57Camara, F.; Oberti, R.
The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Greenbushes, W Australia
American Mineralogist, 2005, 90, 1167-1176
9016794 CIFAl1.33 F0.1 Fe1.26 H3.8 Li1.93 Mg2.42 Mn0.04 Na0.05 O23.9 Si8 Zn0.01P n m a18.336; 17.693; 5.2755
90; 90; 90
1711.47Camara, F.; Oberti, R.
The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Norway
American Mineralogist, 2005, 90, 1167-1176
9016793 CIFAl1.3 F0.13 Fe1.3 H3.74 Li1.93 Mg2.32 Mn0.06 Na0.1 O23.87 Si8 Zn0.01P n m a18.335; 17.693; 5.2743
90; 90; 90
1710.99Camara, F.; Oberti, R.
The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Uto, Sweden
American Mineralogist, 2005, 90, 1167-1176
9016792 CIFAl1.34 F0.09 Fe1.26 H3.82 Li1.98 Mg2.35 Mn0.04 Na0.05 O23.91 Si8 Zn0.01P n m a18.3345; 17.6955; 5.2764
90; 90; 90
1711.86Camara, F.; Oberti, R.
The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Zaire
American Mineralogist, 2005, 90, 1167-1176
9016791 CIFAl1.76 F0.07 Fe1.2 H3.86 Li1.97 Mg2.01 Mn0.04 Na0.02 O23.93 Si8 Zn0.01P n m a18.2754; 17.6569; 5.2738
90; 90; 90
1701.79Camara, F.; Oberti, R.
The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Rwanda
American Mineralogist, 2005, 90, 1167-1176
9016790 CIFAl1.98 F0.02 Fe1.2 H3.96 Li1.71 Mg1.89 Mn0.01 Na0.03 O24 Si7.98P n m a18.277; 17.646; 5.2792
90; 90; 90
1702.63Camara, F.; Oberti, R.
The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: Siberia
American Mineralogist, 2005, 90, 1167-1176
9016789 CIFAl1.97 F0.03 Fe1.23 H3.94 Li1.98 Mg1.8 Mn0.02 Na0.03 O23.97 Si7.99 Zn0.01P n m a18.277; 17.65; 5.2736
90; 90; 90
1701.21Camara, F.; Oberti, R.
The crystal-chemistry of holmquistites: Ferroholmquistite from Greenbushes (Western Australia) and hints for compositional constraints in B-Li amphiboles Sample: HS 119915 Siberia
American Mineralogist, 2005, 90, 1167-1176
9016715 CIFLa0.1 Nb2 O6 Sr0.9P n m a11.021; 7.675; 5.584
90; 90.19; 90
472.327Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M.
Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd]
Materials Research Bulletin, 1994, 29, 743-749
9016677 CIFC Fe2.7 Mn0.3P n m a5.0598; 6.7462; 4.5074
90; 90; 90
153.857Fasiska, E. J.; Jeffery, G. A.
On the cementite structure
Acta Crystallographica, 1965, 19, 463-471
9016657 CIFLa0.2 Nb2 O6 Sr0.8P n m a11.042; 7.665; 5.584
90; 90; 90
472.613Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M.
Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd]
Materials Research Bulletin, 1994, 29, 743-749
9016628 CIFCa2 Fe2 O5P n m a5.3744; 14.6175; 5.5526
90; 90; 90
436.214Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 3.863 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9016584 CIFC Fe3P n m a5.09; 6.748; 4.523
90; 90; 90
155.353Herbstein, F. H.; Smuts, J.
Comparison of X-ray and neutron-diffraction refinements of the structure of cementite Fe3C
Acta Crystallographica, 1964, 17, 1331-1332
9016495 CIFCa Fe0.12 Mg0.88 O4 SiP n m a11.1098; 6.3894; 4.8281
90; 90; 90
342.722Pilati, T.; Demartin, F.; Gramaccioli, C. M.
Thermal parameters for minerals of the olivine group: their implication on vibrational spectra, thermodynamic functions and transferable force fields
Acta Crystallographica, Section B, 1995, 51, 721-733
9016470 CIFAl0.37 Ca2 Fe1.63 O5P n m a5.3246; 14.4558; 5.5273
90; 90; 90
425.444Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 6.267 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9016436 CIFCs6 Mo7 O38 P7P n m a10.084; 21.297; 17.491
90; 90; 90
3756.35Guesdon, A.; Borel, M.; Leclaire, A.; Grandin, A.; Raveau, B.
A mixed-valent molybdenum monophosphate with a "butterfly"-shaped tunnel structure Cs6Mo7O9(PO4)7*H2O _cod_database_code 1001603
Journal of Solid State Chemistry, 1994, 111, 315-321
9016435 CIFMg0.6 Mn1.4 O4 SiP n m a10.52411; 6.17903; 4.83927
90; 90; 90
314.692Yamazaki, S.; Toraya, H.
Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1
Journal of Applied Crystallography, 1999, 32, 51-59
9016247 CIFCa2 Fe2 O5P n m a5.3035; 14.4389; 5.4979
90; 90; 90
421.011Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 9.73 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9016235 CIFAg0.331 Bi3.875 Cu0.203 Pb3.32 S10 Sb0.447P n m a23.652; 4.0539; 19.095
90; 90; 90
1830.88Topa, D.; Makovicky, E.
The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 3
The Canadian Mineralogist, 2010, 48, 1081-1107
9016186 CIFAl2 Ge H2 O6P n m a9.107; 8.551; 4.804
90; 90; 90
374.106Marler, B.; Wunder, B.
Crystal structure of dialuminium dihydroxogermanate, Al~2~GeO~4~(OH)~2~
Zeitschrift für Kristallographie - New Crystal Structures, 1998, 213, 3-3
9016180 CIFAl3 Ca2 H O13 Si3P n m a16.2004; 5.5529; 10.0423
90; 90; 90
903.397Alvaro, M.; Angel, R. J.; Camara, F.
High-pressure behavior of zoisite Note: P = .0001 GPa
American Mineralogist, 2012, 97, 1165-1176
9016171 CIFC O6 Pb2 S2P n m a16.343; 8.76; 4.592
90; 90; 90
657.412Bindi, L.; Nestola, F.; Kolitsch, U.; Guastoni, A.; Zorzi, F.
Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-02
Mineralogical Magazine, 2011, 75, 2721-2732
9016116 CIFMg0.6 Mn1.4 O4 SiP n m a10.52411; 6.17903; 4.83927
90; 90; 90
314.692Yamazaki, S.; Toraya, H.
Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo
Journal of Applied Crystallography, 1999, 32, 51-59
9016013 CIFCa2 Fe2 O5P n m a5.4271; 14.7619; 5.5978
90; 90; 90
448.464Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 0.0001 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9016006 CIFCe O6 Ta TiP n m a10.9694; 7.5288; 5.3829
90; 90; 90
444.554Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9015959 CIFAl3 Ca2 H O13 Si3P n m a16.1353; 5.5062; 9.9432
90; 90; 90
883.396Alvaro, M.; Angel, R. J.; Camara, F.
High-pressure behavior of zoisite Note: P = 2.945 GPa
American Mineralogist, 2012, 97, 1165-1176
9015955 CIFAl0.37 Ca2 Fe1.63 O5P n m a5.3549; 14.541; 5.5524
90; 90; 90
432.341Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 3.729 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9015926 CIFEu O6 Ta2P n m a11.02; 7.64; 5.61
90; 90; 90
472.322Jacobsen, H.; Lissner, F.; Manek, E.; Meyer, G.
Crystal structures of dieuropium(II) ditantalum heptoxide, Eu2Ta2O7 and europium(II) ditantalum hexoxide, EuTa2O6
Zeitschrift fur Kristallographie, 1996, 211, 547-548
9015921 CIFAg0.51 Bi4 Cu0.463 Pb3.446 S10P n m a23.879; 4.0453; 19.017
90; 90; 90
1837Topa, D.; Makovicky, E.
The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 6
The Canadian Mineralogist, 2010, 48, 1081-1107
9015897 CIFLa0.924 Nb1.228 O6 Ti0.772P n m a10.96305; 7.58996; 5.46833
90; 90; 90
455.015Golobic, A.; Skapin, S. D.; Suvorov, D.; Meden, A.
Solving Structural Problems of Ceramic Materials
Croatica Chemica Acta, 2004, 77, 435-446
9015862 CIFAl0.37 Ca2 Fe1.63 O5P n m a5.4042; 14.6835; 5.5947
90; 90; 90
443.954Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 0.0001 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9015849 CIFMn2 O4 SiP n m a10.60016; 6.25753; 4.90338
90; 90; 90
325.245Yamazaki, S.; Toraya, H.
Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo
Journal of Applied Crystallography, 1999, 32, 51-59
9015812 CIFLa0.2 Nb2 O6 Sr0.8P n m a11.042; 7.644; 5.563
90; 90; 90
469.545Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M.
Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd]
Materials Research Bulletin, 1994, 29, 743-749
9015811 CIFAl6.81 As0.093 B O17.884 Sb0.023 Si2.884P n m a4.6971; 11.8149; 20.2267
90; 90; 90
1122.5Groat, L. A.; Evans, R. J.; Grew, E. S.; Pieczka, A.
The crystal chemistry of As- and Sb-bearing dumortierite Sample: D21
The Canadian Mineralogist, 2012, 50, 855-872
9015808 CIFCa H8 O15 Si4 VP n m a9.6329; 13.6606; 9.7949
90; 90; 90
1288.92Danisi, R. M.; Armbruster, T.; Lazic, B.
In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: room temperature
American Mineralogist, 2012, 97, 1874-1880
9015799 CIFBi4 Cu0.73 Pb3.695 S10P n m a23.816; 4.0408; 19.057
90; 90; 90
1833.96Topa, D.; Makovicky, E.
The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 4
The Canadian Mineralogist, 2010, 48, 1081-1107
9015764 CIFCa O13.014 Si4 VP n m a9.4746; 13.262; 9.605
90; 90; 90
1206.89Danisi, R. M.; Armbruster, T.; Lazic, B.
In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: T = 175 C
American Mineralogist, 2012, 97, 1874-1880
9015735 CIFC O6 Pb2 S2P n m a16.32; 8.7616; 4.5809
90; 90; 90
655.02Bindi, L.; Nestola, F.; Kolitsch, U.; Guastoni, A.; Zorzi, F.
Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-01
Mineralogical Magazine, 2011, 75, 2721-2732
9015720 CIFCa2 Fe2 O5P n m a5.3522; 14.5621; 5.5354
90; 90; 90
431.425Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 5.564 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9015659 CIFAl3 Ca2 H O13 Si3P n m a16.0539; 5.4609; 9.8437
90; 90; 90
862.985Alvaro, M.; Angel, R. J.; Camara, F.
High-pressure behavior of zoisite Note: P = 6.511 GPa
American Mineralogist, 2012, 97, 1165-1176
9015658 CIFMg2 O4 SiP n m a10.20141; 5.98348; 4.75534
90; 90; 90
290.266Yamazaki, S.; Toraya, H.
Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1
Journal of Applied Crystallography, 1999, 32, 51-59
9015654 CIFAl3 Ca2 H O13 Si3P n m a16.0271; 5.4473; 9.8119
90; 90; 90
856.622Alvaro, M.; Angel, R. J.; Camara, F.
High-pressure behavior of zoisite Note: P = 7.766 GPa
American Mineralogist, 2012, 97, 1165-1176
9015649 CIFC H Nd O4P n m a7.2333; 4.964; 8.4908
90; 90; 90
304.872Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.
Crystal chemistry of RE(CO3)OH
Zeitschrift fur Kristallographie, 2007, 222, 326-334
9015506 CIFLa0.3 Nb2 O6 Sr0.7P n m a11.046; 7.653; 5.571
90; 90; 90
470.945Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M.
Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd]
Materials Research Bulletin, 1994, 29, 743-749
9015438 CIFAg0.014 Bi4 Cu0.132 Pb3.904 S10P n m a23.87; 4.0647; 19.13
90; 90; 90
1856.08Topa, D.; Makovicky, E.
The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 1
The Canadian Mineralogist, 2010, 48, 1081-1107
9015333 CIFF H Mg OP n m a10.1299; 3.0723; 4.676
90; 90; 90
145.527Crichton, W. A.; Parise, J. B.; Muller, H.; Breger, J.; Marshall, W. G.; Welch, M. D.
Synthesis and structure of magnesium hydroxide fluoride, Mg(OH)F: a topological intermediate between brucite- and rutile-type structures
Mineralogical Magazine, 2012, 76, 25-36
9015305 CIFAl0.37 Ca2 Fe1.63 O5P n m a5.3769; 14.6032; 5.5712
90; 90; 90
437.45Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 2.015 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9015299 CIFNb2 O6 SrP n m a10.9862; 7.7223; 5.5944
90; 90.372; 90
474.612Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M.
Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd]
Materials Research Bulletin, 1994, 29, 743-749
9015294 CIFAl3 Ca2 H O13 Si3P n m a16.0796; 5.4721; 9.869
90; 90; 90
868.365Alvaro, M.; Angel, R. J.; Camara, F.
High-pressure behavior of zoisite Note: P = 5.533 GPa
American Mineralogist, 2012, 97, 1165-1176
9015281 CIFAl3 Ca2 H O13 Si3P n m a16.0845; 5.477; 9.8785
90; 90; 90
870.245Alvaro, M.; Angel, R. J.; Camara, F.
High-pressure behavior of zoisite Note: P = 5.145 GPa
American Mineralogist, 2012, 97, 1165-1176
9015277 CIFLa0.3 Nb2 O6 Sr0.7P n m a11.053; 7.64; 5.556
90; 90; 90
469.176Istomin, S. Y.; D'yachenko, O. G.; Antipov, E. V.; Svensson, G.; Nygren, M.
Synthesis and characterisation of reduced niobates [Sr1-xLnxNb2O6, Ln = La, Nd]
Materials Research Bulletin, 1994, 29, 743-749
9015267 CIFCu3 Mo1.94 O9 S0.06P n m a7.6638; 6.867; 14.5554
90; 90; 90
766.012Zelenski, M. E.; Zubkova, N. V.; Pekov, I. V.; Polekhovsky, Y. S.; Pushcharovsky, D. Y.
Cupromolybdite, Cu3O(MoO4)2, a new fumarolic mineral from the Tolbachik volcano, Kamchatka Peninsula, Russia
European Journal of Mineralogy, 2012, 24, 749-757
9015246 CIFCa O12.18 Si4 VP n m a9.39; 13.11; 9.39
90; 90; 90
1155.94Danisi, R. M.; Armbruster, T.; Lazic, B.
In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: T = 350 C
American Mineralogist, 2012, 97, 1874-1880
9015230 CIFAs Cd Cu H O5P n m a7.415; 5.89; 9.016
90; 90; 90
393.768Effenberger, H.
CdCu(OH)(AsO4), the first Cd member of the adelite-descloizite structure type
Zeitschrift fur Kristallographie, 2002, 19, 85-85
9015222 CIFNd O6 Ta TiP n m a10.9771; 7.5051; 5.3602
90; 90; 90
441.596Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9015192 CIFMg Mn O4 SiP n m a10.451; 6.12446; 4.80757
90; 90; 90
307.717Yamazaki, S.; Toraya, H.
Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1
Journal of Applied Crystallography, 1999, 32, 51-59
9015130 CIFH8 O12 S2 UP n m a14.674; 11.093; 5.688
90; 90; 90
925.885Kierkegaard, P.
The crystal structure of U(SO4)2*4H2O
Acta Chemica Scandinavica, 1956, 10, 599-616
9015074 CIFMg Mn O4 SiP n m a10.451; 6.12446; 4.80757
90; 90; 90
307.717Yamazaki, S.; Toraya, H.
Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo
Journal of Applied Crystallography, 1999, 32, 51-59
9015070 CIFBa Cu2 Ge2 O7P n m a7.04765; 13.407; 7.02755
90; 90; 90
664.018Yamada, T.; Hiroi, Z.; Takano, M.
Spin-1/2 quantum antiferromagnetic chains with tunable superexchange interactions found in BaCu2(Si1-xGex)2O7
Journal of Solid State Chemistry, 2001, 156, 101-109
9015061 CIFAl6.79 B O18 Si3P n m a4.6995; 11.779; 20.1671
90; 90; 90
1116.36Groat, L. A.; Evans, R. J.; Grew, E. S.; Pieczka, A.
The crystal chemistry of As- and Sb-bearing dumortierite Sample: D67
The Canadian Mineralogist, 2012, 50, 855-872
9015055 CIFAl3 H O13 Pb2 Si3P n m a16.4529; 5.6432; 10.3631
90; 90; 90
962.183Dorsam, G.; Liebscher, A.; Wunder, B.; Franz, G.; Gottschalk, M.
Synthesis of Pb-zoisite and Pb-lawsonite
Neues Jahrbuch fur Mineralogie, Abhandlungen, 2011, 188, 99-110
9015033 CIFLa O6 Ta TiP n m a10.942; 7.5831; 5.4614
90; 90; 90
453.156Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9015028 CIFB F4 H4 NP n m a9.077; 5.679; 7.279
90; 90; 90
375.22Caron, A. P.; Ragle, J. L.
Refinement of the structure of orthorhombic ammonium tetrafluoroborate, NH4BF4
Acta Crystallographica, Section B, 1971, 27, 1102-1107
9014929 CIFCa O14.249 Si4 VP n m a9.609; 13.6833; 9.7559
90; 90; 90
1282.73Danisi, R. M.; Armbruster, T.; Lazic, B.
In situ dehydration behavior of zeolite-like cavansite: A single-crystal X-ray study Note: T = 75 C
American Mineralogist, 2012, 97, 1874-1880
9014902 CIFF H O ZnP n m a10.228; 3.1125; 4.7165
90; 90; 90
150.148Crichton, W. A.; Parise, J. B.; Muller, H.; Breger, J.; Marshall, W. G.; Welch, M. D.
Synthesis and structure of magnesium hydroxide fluoride, Mg(OH)F: a topological intermediate between brucite- and rutile-type structures Note: transformed from Serier et al (2007)
Mineralogical Magazine, 2012, 76, 25-36
9014892 CIFBa Cu2 O7 Si2P n m a6.86058; 13.17507; 6.89589
90; 90; 90
623.31Yamada, T.; Hiroi, Z.; Takano, M.
Spin-1/2 quantum antiferromagnetic chains with tunable superexchange interactions found in BaCu2(Si1-xGex)2O7
Journal of Solid State Chemistry, 2001, 156, 101-109
9014882 CIFBi4 Cu0.26 Pb3.867 S10P n m a23.894; 4.0616; 19.143
90; 90; 90
1857.79Topa, D.; Makovicky, E.
The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 2
The Canadian Mineralogist, 2010, 48, 1081-1107
9014842 CIFAg0.308 Bi4 Cu0.358 Pb3.643 S10P n m a23.846; 4.0559; 19.066
90; 90; 90
1844.01Topa, D.; Makovicky, E.
The crystal chemistry of cosalite based on new electron-microprobe data and single-crystal determination of the structure Note: Sample 5
The Canadian Mineralogist, 2010, 48, 1081-1107
9014764 CIFCa2 Fe2 O5P n m a5.3956; 14.6756; 5.5703
90; 90; 90
441.077Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.0 Note: P = 2.249 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9014745 CIFO6 Ta Tb TiP n m a10.977; 7.414; 5.238
90; 90; 90
426.287Thorogood, G. J.; Avdeev, M.; Kennedy, B. J.
Structural studies of the aeschynite-euxenite transformation in the series Ln(TiTa)O6 Ln = lanthanide
Solid State Sciences, 2010, 12, 1263-1269
9014736 CIFC O6 Pb2 S2P n m a16.326; 8.773; 4.583
90; 90; 90
656.414Bindi, L.; Nestola, F.; Kolitsch, U.; Guastoni, A.; Zorzi, F.
Fassinaite, Pb22+(S2O3)(CO3), the first mineral with coexisting thiosulphate and carbonate groups: description and crystal structure Note: Sample ID FAS-03 Baden-Wurttemberg, Germany
Mineralogical Magazine, 2011, 75, 2721-2732
9014729 CIFAl3 Ca2 H O13 Si3P n m a16.176; 5.5342; 10.0007
90; 90; 90
895.275Alvaro, M.; Angel, R. J.; Camara, F.
High-pressure behavior of zoisite Note: P = 1.144 GPa
American Mineralogist, 2012, 97, 1165-1176
9014702 CIFC H O4 SmP n m a7.1388; 4.9151; 8.4717
90; 90; 90
297.254Tahara, T.; Nakai, I.; Miyawaki, R.; Matsubara, S.
Crystal chemistry of RE(CO3)OH
Zeitschrift fur Kristallographie, 2007, 222, 326-334
9014661 CIFAl0.37 Ca2 Fe1.63 O5P n m a5.2953; 14.3759; 5.5037
90; 90; 90
418.968Vanpeteghem, C. B.; Angel, R. J.; Zhao, J.; Ross, N. L.; Redhammer, G. J.; Seifert, F.
The effect of oxygen vacancies and aluminium substitution on the high-pressure properties of brownmillerite-structured Ca2Fe2-xAlxO5 Note: x = 0.37 Note: P = 8.89 GPa
Physics and Chemistry of Minerals, 2008, 35, 493-504
9014610 CIFAl6.12 As0.1 B O16.86 Sb1.14 Si1.3 Ta0.3P n m a4.6893; 11.881; 20.394
90; 90; 90
1136.22Zubkova, N. V.; Pushcharovskii, D. Y.; Kabalov, Y. K.; Kazantsev, S. S.; Voloshin, A. V.
Crystal structure of holtite II
Crystallography Reports, 2006, 51, 16-22
9014579 CIFAl6.454 As0.21 B H O17.64 Sb0.36 Si2.43 Ta0.258P n m a4.695; 11.906; 20.38
90; 90; 90
1139.21Kazantsev, S. S.; Pushcharovsky, D. Y.; Pasero, M.; Merlino, S.; Zubkova, N. V.; Kabalov, Y. K.; Voloshin, A. V.
Crystal structure of holtite I
Crystallography Reports, 2005, 50, 42-47

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