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 |
|---|---|---|---|---|---|---|
| 8103871 | CIF | Ag B F4 H2 O | P b c a | 7.966; 7.794; 13.42 90; 90; 90 | 833.208 | Ludwig, W.; Wartchow, R. Crystal structure of silver tetrafluoroborate monohydrate, Ag (B F4) (H2 O) Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 631-631 |
| 8104072 | CIF | Ag Cl H2 O5 | P b c a | 8.122; 7.829; 13.56 90; 90; 90 | 862.242 | Wartchow, R.; Ludwig, W. Crystal structure of silver perchlorate monohydrate, Ag (Cl O4) (H2 O) Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 879-879 |
| 1509291 | CIF | Ag Cu O4 P | P b c a | 7.5; 15.751; 5.702 90; 90; 90 | 673.592 | Oumba, M.T.; Quarton, M. Proprietes de l'ion Cu2+ dans la structure de Ag Cu P O4 - beta Materials Research Bulletin, 1983, 18, 967-974 |
| 4312674 | CIF | Ag F11 Sb2 | P b c a | 10.918; 12.4628; 38.802 90; 90; 90 | 5279.7 | Zoran Mazej; Primož Benkič Silver(I) Undecafluorodiantimonate(V) Inorganic Chemistry, 2003, 42, 8337-8343 |
| 1509320 | CIF | Ag F2 | P b c a | 5.073; 5.529; 5.813 90; 90; 90 | 163.047 | Fischer, P.; Schwarzenbach, D.; Rietveld, H.M. Crystal and magnetic structure of silver difluoride. I. Determination of the Ag F2 structure Journal of Physics and Chemistry of Solids, 1971, 32, 543-550 |
| 1509321 | CIF | Ag F2 | P b c a | 5.568; 5.831; 5.101 90; 90; 90 | 165.614 | Mueller, B.G.; Hoppe, R.; Zemva, B.; Jesih, A.; Lutar, K.; Becker, S.; Bachmann, B. Einkristalluntersuchungen an Ag F2 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 588, 77-83 |
| 1509346 | CIF | Ag Ga P2 Se6 | P b c a | 12.169; 22.484; 7.473 90; 90; 90 | 2044.67 | Pfeiff, R.; Kniep, R. Quaternary selenodiphosphates(IV):M(I)M(III)(P2Se6), (M(I)=Cu,Ag;M(III)=Cr,Al,Ga,In) Journal of Alloys Compd., 1992, 186, 111-133 |
| 1509468 | CIF | Ag N O3 | P b c a | 6.995; 7.328; 10.118 90; 90; 90 | 518.642 | Trotter, J.; Gibbons, C.S. Crystal structure of exo-tricyclo(3.2.1.02,4)oct-6-ene-silver nitrate, and a refinement of the silver nitrate structure Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971), 1971, 1971, 2058-2062 |
| 7004808 | CIF | Ag N3 O4 | P b c a | 5.804; 9.7496; 13.9105 90; 90; 90 | 787.15 | Klapötke, Thomas M.; Krumm, Burkhard; Scherr, Matthias First structural characterization of solvate-free silver dinitramide, Ag[N(NO2)2] Dalton Transactions, 2008, 5876-5878 |
| 1563339 | CIF | Ag O7 Te U | P b c a | 7.0849; 11.986; 13.913 90; 90; 90 | 1181.5 | Ling, Jie; Ward, Matthew; Burns, Peter C. Hydrothermal syntheses and structures of the uranyl tellurates AgUO2(HTeO5) and Pb2UO2(TeO6) Journal of Solid State Chemistry, 2011, 184, 401-404 |
| 1509622 | CIF | Ag11 K O16 V4 | P b c a | 16.5328; 10.6286; 10.5452 90; 90; 90 | 1853.01 | Jansen, M.; Kovalevskiy, A. Synthesis and crystal structure analysis of K Ag11 (V O4)4 Zeitschrift fuer Anorganische und Allgemeine Chemie, 2006, 632, 413-436 |
| 2018859 | CIF | Ag2 Al4 Cl10 O2 | P b c a | 11.24; 12.278; 12.955 90; 90; 90 | 1787.85 | Jentsch, D.; Schwarzmann, E.; Sheldrick, G.M.; Jones, P.G. Disilver(I) Decachlorodioxotetraaluminate(III), Ag2 (Al4 Cl10 O2) Acta Crystallographica C (39,1983-), 1983, 39, 1173-1174 |
| 7209369 | CIF | Ag2 Hg O6 Se2 | P b c a | 6.8206; 11.237; 16.876 90; 90; 90 | 1293.43 | Weil, M. Investigations in the systems Ag - Hg - X - O (X = As(V), Se(IV), Se(VI)): hydrothermal single crystal growth of Ag3 As O4, Ag Hg(I)2 As O4, Ag Hg(II) As O4, Ag2 Se O4 and the crystal structure of Ag2 Hg(II) (Se O3)2 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2003, 58, 1091-1096 |
| 7024504 | CIF | Ag2 I3 O11 V | P b c a | 35.245; 7.7757; 7.172 90; 90; 90 | 1965.5 | Sun, Chuan-Fu; Hu, Chun-Li; Kong, Fang; Yang, Bing-Ping; Mao, Jiang-Gao Syntheses and crystal structures of four new silver(I) iodates with d(0)-transition metal cations. Dalton transactions (Cambridge, England : 2003), 2010, 39, 1473-1479 |
| 1007100 | CIF | Ag4 O7 V2 | P b c a | 18.82; 10.89; 13.925 90; 90; 90 | 2853.9 | Masse, R; Averbuch-Pouchot, M T; Durif, A; Guitel, J C Chemical Preparation and Crystal Structure of Silver Pyrovanadate, Ag~4~ V~2~ O~7~ Acta Crystallographica C (39,1983-), 1983, 39, 1608-1610 |
| 2011450 | CIF | Al As H4 O6 | P b c a | 8.8218; 9.8252; 10.1163 90; 90; 90 | 876.8 | Harrison, William T. A. Synthetic mansfieldite, AlAsO~4~.2H~2~O Acta Crystallographica, Section C, 2000, 56, e421-e421 |
| 7708360 | CIF | Al B H2 O10 Se3 | P b c a | 8.465; 8.7788; 21.9237 90; 90; 90 | 1629.21 | Cao, Ming-Yang; Hu, Chun-Li; Kong, Fang; Xiong, Zheyao; Mao, Jiang-Gao M(B(SeO3)3)H2O(M = Al, Ga):The first boroselenites with a unique sandwich like double-layer structure Dalton Transactions, 2021 |
| 1531606 | CIF | Al Br3 H3 N | P b c a | 11.529; 12.188; 19.701 90; 90; 90 | 2768.29 | Jacobs, H.; Schroeder, F.O. Monoammoniates of aluminium halides: the crystal structures of (Al Br3) * (N H3) and (Al I3) * (N H3) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 327-329 |
| 9000571 | CIF | Al Ca H9 Mg O13 P2 | P b c a | 14.723; 18.746; 7.107 90; 90; 90 | 1961.51 | Moore, P. B.; Araki, T. Overite, segelerite, and jahnsite: a study in combinatorial polymorphism American Mineralogist, 1977, 62, 692-702 |
| 1530734 | CIF | Al Cl3 H3 N | P b c a | 9.895; 10.148; 11.544 90; 90; 90 | 1159.19 | Semenenko, K.N.; Lobkovskii, E.B.; Kravchenko, O.V.; Polyakova, V.B.; Korobov, I.I. Structure and vibrational spectra of aluminium chloride monoammoniate Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR)), 1978, 4, 1649-1652 |
| 1531607 | CIF | Al H3 I3 N | P b c a | 13.536; 8.759; 14.348 90; 90; 90 | 1701.12 | Jacobs, H.; Schroeder, F.O. Monoammoniates of aluminium halides: the crystal structures of (Al Br3) * (N H3) and (Al I3) * (N H3) Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 327-329 |
| 1534642 | CIF | Al H3 O3 | P b c a | 8.6857; 5.0521; 9.4954 90; 90; 90 | 416.668 | Liu, H.; Tse, J.S.; Hu, J.; Liu, Z.; Wang, L.; Weidner, D.J.; Chen, J.; Meng, Y.; Mao, H.-K.; Haeusermann, D. Structural Refinement of the High-Pressure Phase of Aluminium Trihydroxide: In-Situ High-Pressure Angle Dispersive Synchrotron X-ray Diffraction and Theoretical Studies J. Phys. Chem. B, 2005, 109, 8857-8860 |
| 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 |
| 1526660 | CIF | Al K O2 | P b c a | 5.4482; 10.916; 15.445 90; 90; 90 | 918.554 | Sokolowski, J.; Kotarba, A. The structure of potassium aluminium oxide K Al O2 Materials Science Forum, 2000, 321, 954-959 |
| 2105200 | CIF Paper | Al K O2 | P b c a | 5.43867; 10.9236; 15.4564 90; 90; 90 | 918.26 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 2105201 | CIF Paper | Al K O2 | P b c a | 5.4457; 10.9401; 15.4698 90; 90; 90 | 921.64 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 2105202 | CIF Paper | Al K O2 | P b c a | 5.456; 10.9617; 15.4893 90; 90; 90 | 926.37 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 2105203 | CIF Paper | Al K O2 | P b c a | 5.4668; 10.9862; 15.5103 90; 90; 90 | 931.54 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 2105204 | CIF Paper | Al K O2 | P b c a | 5.4788; 11.0123; 15.5359 90; 90; 90 | 937.35 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 2105205 | CIF Paper | Al K O2 | P b c a | 5.4888; 11.0346; 15.5598 90; 90; 90 | 942.41 | Voronin, Vladimir I.; Shekhtman, Georgi Sh.; Blatov, Vladislav A. The natural tiling approach to cation conductivity in KAlO~2~ polymorphs Acta Crystallographica Section B, 2012, 68, 356-363 |
| 7117899 | CIF | Al Na5 O4 | P b c a | 5.894; 17.87; 10.095 90; 90; 90 | 1063.26 | Barker, M.G.; Gadd, P.G.; Begley, M.J. Preparation and crystal structures of the first alkali-rich sodium aluminates Na7 Al3 O8 and Na5 Al O4 Journal of the Chemical Society. Chemical Communications (1972-), 1981, 1981, 379-381 |
| 1526641 | CIF | Al O4 P | P b c a | 18.02411; 13.91737; 9.65536 90; 90; 90 | 2422.03 | Kirchner, R.M.; Grosse-Kunstleve, R.W.; Pluth, J.J.; Smith, J.V.; Broach, R.W.; Wilson, S.T. The structures of as-synthesized Al P O4 - 53(A), calcined dehydrated Al P O4 - 53(B), and Al P O4 - 53(C), a new phase determined by the FOCUS method Microporous and Mesoporous Materials, 2000, 39, 319-332 |
| 1533070 | CIF | Al O4 P | P b c a | 14.0343; 15.1794; 17.4024 90; 90; 90 | 3707.27 | Roux, M.; Marichal, C.; le Meins, J.M.; Chezeau, J.M.; Baerlocher, C. Solid state NMR and X-ray diffraction study of three forms of the aluminophosphate Al P O4 - ZON Microporous and Mesoporous Materials, 2003, 63, 163-176 |
| 9003577 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.509 O6 Si1.997 Ti0.002 | P b c a | 18.3718; 8.8836; 5.2334 90; 90; 90 | 854.131 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 904 deg C ORD American Mineralogist, 2005, 90, 155-161 |
| 9003574 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3668; 8.8725; 5.2289 90; 90; 90 | 852.099 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: untreated American Mineralogist, 2005, 90, 155-161 |
| 9003575 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3653; 8.8819; 5.2305 90; 90; 90 | 853.193 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 980 deg C DIS American Mineralogist, 2005, 90, 155-161 |
| 9003578 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3645; 8.881; 5.2284 90; 90; 90 | 852.727 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 856 deg C ORD American Mineralogist, 2005, 90, 155-161 |
| 9003579 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.541 O6 Si1.997 Ti0.002 | P b c a | 18.3559; 8.8741; 5.2256 90; 90; 90 | 851.209 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 806 deg C ORD American Mineralogist, 2005, 90, 155-161 |
| 9003576 | CIF | Al0.003 Ca0.024 Mg1.433 Mn0.542 O6 Si1.997 Ti0.002 | P b c a | 18.3686; 8.8828; 5.2287 90; 90; 90 | 853.139 | Stimpfl, M. The Mn, Mg-intracrystalline exchange reaction in donpeacorite (Mn0.54Ca0.03Mg1.43Si2O6) and its relation to the fractionation behavior of Mn in Fe, Mg-orthopyroxene Sample: quenched from 900 deg C DIS American Mineralogist, 2005, 90, 155-161 |
| 9001749 | CIF | Al0.028 Ca0.036 Cr0.004 Fe0.795 Mg1.134 Mn0.026 O6 Si1.986 Ti0.005 | P b c a | 18.316; 8.907; 5.218 90; 90; 90 | 851.268 | Domeneghetti, M. C.; Tazzoli, V.; Ballaran, T. B.; Molin, G. M. Orthopyroxene from the Serra de Mage meteorite: A structure-refinement procedure for a Pbca phase coexisting with a C2/c exsolved phase Sample Opx SDM N.13, natural American Mineralogist, 1996, 81, 842-846 |
| 9001750 | CIF | Al0.028 Ca0.036 Cr0.004 Fe0.801 Mg1.128 Mn0.026 O6 Si1.986 Ti0.005 | P b c a | 18.32; 8.917; 5.219 90; 90; 90 | 852.573 | Domeneghetti, M. C.; Tazzoli, V.; Ballaran, T. B.; Molin, G. M. Orthopyroxene from the Serra de Mage meteorite: A structure-refinement procedure for a Pbca phase coexisting with a C2/c exsolved phase Sample Opx SDM N.7, heated American Mineralogist, 1996, 81, 842-846 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 1537228 | CIF | Al0.06 Fe0.096 Mg0.854 O3 Si0.97 | P b c a | 18.2248; 8.7822; 5.1927 90; 90; 90 | 831.112 | Ganguly, J.; Ghose, S. Aluminous orthopyroxene: Order-disorder, thermodynamic properties, and petrologic implications Contributions to Mineralogy and Petrology (23,1969-), 1979, 69, 375-385 |
| 1566757 | CIF HKL | Al0.067 Fe0.067 Mg1.94 O6 Si1.93 | P b c a | 5.1815; 18.2321; 8.8085 90; 90; 90 | 832.14 | Glazyrin, K.; Khandarkhaeva, S.; Fedotenko, T.; Dong, W.; Laniel, D.; Seiboth, F.; Schropp, A.; Garrevoet, J.; Brückner, D.; Falkenberg, G.; Kubec, A.; David, C.; Wendt, M.; Wenz, S.; Dubrovinsky, L.; Dubrovinskaia, N.; Liermann, H.-P. Sub-micrometer focusing setup for high-pressure crystallography at the Extreme Conditions beamline at PETRAIII Journal of Synchrotron Radiation, 2022, 29, 654-663 |
| 1537231 | CIF | Al0.088 Mg0.956 O3 Si0.956 | P b c a | 18.1991; 8.78; 5.1666 90; 90; 90 | 825.561 | Ganguly, J.; Ghose, S. Aluminous orthopyroxene: Order-disorder, thermodynamic properties, and petrologic implications Contributions to Mineralogy and Petrology (23,1969-), 1979, 69, 375-385 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 2101702 | CIF Paper | Al0.15 Mg0.79 Na1.74 O4 Si1.06 | P b c a | 10.487; 14.351; 5.243 90; 90; 90 | 789.1 | Withers, Ray L.; Lobo, Charlene; Thompson, John G.; Schmid, Siegbert A Modulation Wave Approach to the Structural Characterization of Three New Cristobalite-Related Sodium Magnesiosilicates Acta Crystallographica Section B, 1997, 53, 203-220 |
| 1526735 | CIF | Al0.196 Ca0.069 Fe0.409 Mg1.49 O6 Si1.85 | P b c a | 18.276; 8.819; 5.196 90; 90; 90 | 837.471 | Takeda, H. Crystallographic Studies of Coexisting Aluminan Orthopyroxene and Augite of High-Pressure Origin Journal of Geophysical Research, 1972, 77, 5798-5811 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 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 |
| 2220936 | CIF Paper | Al0.95 As Co0.05 H4 O6 | P b c a | 8.79263; 9.79795; 10.08393 90; 90; 90 | 868.728 | Zoppi, Matteo; Pratesi, Giovanni Rietveld refinement of a natural cobaltian mansfieldite from synchrotron data Acta Crystallographica Section E, 2009, 65, i6-i7 |
| 2002895 | CIF Paper | Al1.55 Na1.55 O4 Si0.45 | P b c a | 10.385; 14.198; 5.1925 90; 90; 90 | 765.6 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
| 2002893 | CIF Paper | Al1.75 Na1.75 O4 Si0.25 | P b c a | 10.416; 14.25; 5.2038 90; 90; 90 | 772.4 | Thompson, John G; Withers, Ray L.; Melnitchenko, Alexandra; Palethorpe, Stephen R. Cristobalite-Related Phases in the NaAlO~2~‒NaAlSiO~4~ System. I. Two Tetragonal and Two Orthorhombic Structures Acta Crystallographica Section B, 1998, 54, 531-546 |
| 2106230 | CIF | Al2 Ba H4 O6 | P b c a | 12.99; 12.34; 7.19 90; 90; 90 | 1152.53 | Ahmed, A.H.M.; Dent Glasser, L.S. Barium Aluminate Hydrates. III. The Crystal Structure of alpha- Ba (Al O (O H)2)2 Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1686-1690 |
| 7129139 | CIF | Al2 Br8 Sm | P b c a | 12.0436; 11.959; 20.842 90; 90; 90 | 3001.9 | Schäfer, Thomas C.; Sorg, Jens; Sedykh, Alexander E.; Müller-Buschbaum, Klaus Red emitting Sm(II) phosphors: Thermally switchable Luminescence in Sm(AlX4)2 (X = Cl, Br) by 5d-4f and intra-4f transitions Chemical Communications, 2021 |
| 4343650 | CIF | Al2 Cl8 Te4 | P b c a | 10.746; 14.112; 11.845 90; 90; 90 | 1796.27 | Couch, T.W.; Lokken, D.A.; Corbett, J.D. The crystal structures of tetratellurium(2+) tetrachloroaluminate and heptachlorodialuminate, Te4(2+) (Al Cl4)2(-) and Te4(2+) (Al2 Cl7)2(-) Inorganic Chemistry, 1972, 11, 357-362 |
| 1537019 | CIF | Al32 H123.68 O189.84 P32 | P b c a | 14.49297; 14.87313; 17.57384 90; 90; 90 | 3788.14 | Fjellvag, H.; Akporiaye, D.E.; Halvorsen, E.N.; Karlsson, A.; Lillerud, K.P.; Kongshaug, K.O. Crystal structure and MAS-NMR study of rehydrated UiO-7 Solid State Sciences, 2001, 3, 603-611 |
| 8103596 | CIF | Al5.175 Ca8.393 Fe0.45 Na0.875 O18 Si0.375 | P b c a | 10.879; 10.845; 15.106 90; 90; 90 | 1782.25 | Takeuchi, Y.; Nishi, F.; Maki, I. Crystal chemical characterization of the (Ca O)3 * (Al2 O3) - (Na2 O) solid solution series Zeitschrift fuer Kristallographie (149,1979-), 1980, 152, 259-307 |
| 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 |
| 9003380 | CIF | As Ba H3 O5 | P b c a | 7.7519; 8.759; 14.668 90; 90; 90 | 995.941 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
| 9003379 | CIF | As Ba0.11 H3 O5 Sr0.89 | P b c a | 7.443; 8.477; 14.38 90; 90; 90 | 907.296 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
| 2106855 | CIF | As Ca H7 O7 | P b c a | 11.195; 10.713; 11.179 90; 90; 90 | 1340.72 | Catti, M.; Ferraris, G. Hydrogen bonding in the crystalline state. Crystal structure of Ca H As O4 (H2 O)3 Acta Crystallographica B (24,1968-38,1982), 1973, 29, 90-96 |
| 1562759 | CIF | As Cs Cu2 S3 | P b c a | 9.531; 10.433; 13.355 90; 90; 90 | 1328 | Yao, Hua-Gang; Ji, Min; Ji, Shou-Hua; An, Yong-Lin Synthesis, structure and characterization of two new copper(І)-thioarsenates (ІІІ) constructed by the [AsS3]3− and CuSx units Journal of Solid State Chemistry, 2013, 198, 289-294 |
| 1540957 | CIF | As Cs Se2 | P b c a | 6.755; 9.689; 16.645 90; 90; 90 | 1089.4 | Sheldrick, W.S.; Haeusler, H.J. Zur Kenntnis von Alkalimetaselenoarseniten. Darstellung und Kristallstrukturen von M As Se2, M = K, Rb, Cs Zeitschrift fuer Anorganische und Allgemeine Chemie, 1988, 561, 139-148 |
| 4327215 | CIF | As F10 N S Xe | P b c a | 8.7844; 12.3857; 16.255 90; 90; 90 | 1768.56 | Gregory L. Smith; Hélène P. A. Mercier; Gary J. Schrobilgen Synthesis of [F3S\τbNXeF][AsF6] and Structural Study by Multi-NMR and Raman Spectroscopy, Electronic Structure Calculations, and X-ray Crystallography Inorganic Chemistry, 2007, 46, 1369-1378 |
| 4031796 | CIF | As F10 N S2 | P b c a | 14.909; 9.843; 12.113 90; 90; 90 | 1777.57 | Brooks, W.V.F.; Wong, C.-M.; Passmore, J.; MacLean, G.K.; White, P.S. Reaction of S2 N As F6 with Halogens: Preparation and X-Ray Crystal Structure of (S F2)2 N As F6; Preparation of (S Br2)2 N As F6,and Vibrational Spectrum and Normal-Co-Ordinate Analysis of the (SX)2 N(+) (X=Cl or Br) Cations Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-), 1983, 1983, 1961-1983 |
| 2212542 | CIF HKL Paper | As Fe H4 O6 | P b c a | 8.942; 10.075; 10.339 90; 90; 90 | 931.4 | Yan Xu; Guang-Peng Zhou; Xue-Fang Zheng Redetermination of iron(III) arsenate dihydrate Acta Crystallographica Section E, 2007, 63, i67-i69 |
| 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 |
| 9003378 | CIF | As H3 O5 Sr | P b c a | 7.4361; 8.4808; 14.348 90; 90; 90 | 904.843 | Jimenez, A.; Prieto, M.; Salvado, M. A.; Garcia-Granda S Structure and crystallization behavior of the (Ba,Sr)HAsO4.H2O solid-solution in aqueous environments American Mineralogist, 2004, 89, 601-609 |
| 1531142 | CIF | As H4 In O6 | P b c a | 9.09; 10.344; 10.468 90; 90; 90 | 984.274 | Chen Zhenxia; Zhao, D.-Y.; Weng, L.-H.; Zhou, Y.-M.; Zhang, H.-Y. Synthesis and structure of a new three-dimensional microporous indium arsenate Hua Hsueh Hsueh Pao, 2002, 60, 305-309 |
| 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 |
| 1561966 | CIF | As Li3 O25 W7 | P b c a | 7.2438; 10.0815; 49.0616 90; 90; 90 | 3582.9 | Zhao, Pei; Mangir Murshed, M.; Huq, Ashfia; Grossmann, Henrike K.; Mädler, Lutz; Alekseev, Evgeny V.; Gesing, Thorsten M. Nanoscale building blocks in a novel lithium arsenotungsten bronze: Synthesis and characterization Journal of Solid State Chemistry, 2015, 226, 81-87 |
| 2013927 | CIF HKL Paper | As Na O2 | P b c a | 6.7762; 5.0901; 14.3098 90; 90; 90 | 493.57 | Lee, Clare; Harrison, William T. A. The <i>catena</i>-arsenite chain anion, [AsO~2~]~<i>n~</i>^<i>n^{-</i>}: (H~3~NCH~2~CH~2~NH~3~)~0.5~[AsO~2~] and NaAsO~2~ (revisited) Acta Crystallographica Section C, 2004, 60, m215-m218 |
| 2310632 | CIF | As Na O2 | P b c a | 14.314; 6.779; 5.086 90; 90; 90 | 493.518 | Menary, J.W. The Crystal Structure of Sodium Polymetaarsenite (Na As O2)X Acta Crystallographica (1,1948-23,1967), 1958, 11, 742-743 |
| 1527333 | CIF | As Na Se2 | P b c a | 5.83; 24.27; 11.82 90; 90; 90 | 1672.46 | Eisenmann, B.; Schaefer, H. Ueber Seleno- und Telluroarsenite, -antimonite und -bismutite Zeitschrift fuer Anorganische und Allgemeine Chemie, 1979, 456, 87-94 |
| 4340531 | CIF | As Zn | P b c a | 5.6607; 7.2774; 7.5599 90; 90; 90 | 311.43 | Fischer, Andreas; Eklöf, Daniel; Benson, Daryn E.; Wu, Yang; Scheidt, Ernst-Wilhelm; Scherer, Wolfgang; Häussermann, Ulrich Synthesis, Structure, and Properties of the Electron-Poor II-V Semiconductor ZnAs. Inorganic chemistry, 2014, 53, 8691-8699 |
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