Crystallography Open Database
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Searching space group like 'C 1 m 1'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1000145 | CIF | H2 Na5 O15 P3 V2 | C 1 m 1 | 6.3089; 20.10379; 5.1172 90; 91.134; 90 | 648.9 | Le Bail, A On the structure of Na5 V2 P3 O14 . (H2 O) Journal of Solid State Chemistry, 1993, 102, 281-282 |
1000472 | CIF | H2 Na5 O15 P3 V2 | C 1 m 1 | 6.3089; 20.10379; 5.1172 90; 91.134; 90 | 648.9 | Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Leblanc, M; Raveau, B Na5 V2 P3 O14 . H2 O, a tetravalent vanadium phosphate with alayer structure and a pure pyramidal coordination of V(IV) Journal of Solid State Chemistry, 1992, 96, 390-396 |
1001332 | CIF | F12 H2 Np3 O | C 1 m 1 | 12.023; 11.723; 8.435 90; 128.77; 90 | 926.9 | Cousson, A; Gasperin, M Nouvelle description du tetrafluorure de neptunium hydrate, Np~3~ F~12~ H~2~ O Acta Crystallographica C (39,1983-), 1985, 41, 804-805 |
1001668 | CIF | C76.039 S48 | C 1 m 1 | 10.41; 20.5; 19.48 90; 98.8; 90 | 4108.2 | Michel, R H; Kappes, M M; Adelmann, P; Roth, G Preparation and Crystal Structure of C76(S8)6: A First Step towards the Crystallography of Higher Fullerenes Angewandte Chemie (German Edition), 1994, 106, 1742-1746 |
1001719 | CIF | Co O3.111 Sr0.9999 Tl0.41 | C 1 m 1 | 4.95; 25.18999; 11.66 90; 97.76; 90 | 1440.6 | Boullay, P; Domenges, B; Hervieu, M; Groult, D; Raveau, B Evidence for the first misfit layer oxide Tl0.41 (Sr0.9 O)1.12 Co O2 Chemistry of Materials (1,1989-, 1996, 8, 1482-1489 |
1008044 | CIF | Er3 F10 K | C 1 m 1 | 14.08; 8.137; 28.28 90; 109.45; 90 | 3055.1 | Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine Annales de Chimie (Paris) (Vol=Year), 1978, 1978, 417-427 |
1008837 | CIF | F7 Ho2 K | C 1 m 1 | 14.287; 8.004; 11.95 90; 125.33; 90 | 1114.9 | le Fur, Y.; Aléonard, S.; Gorius, M. F.; Roux, M. T. Structure des phases de type α-KEr~2~F~7~ Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry, 1982, 38, 1431-1436 |
1010268 | CIF | K N O2 | C 1 m 1 | 4.45; 4.99; 7.31 90; 114.83; 90 | 147.3 | Ziegler, G E The Crystal Structure of Potassium Nitrite, K N O~2~ Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1936, 94, 491-499 |
1011246 | CIF | Al2 H8 O11 Si2 | C 1 m 1 | 5.2; 8.92; 10.25 90; 100; 90 | 468.2 | Mehmel, M Ueber die Struktur von Halloysit und Metahalloysit. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1935, 90, 35-43 |
1011247 | CIF | Al2 H4 O9 Si2 | C 1 m 1 | 5.15; 8.9; 7.57 90; 100; 90 | 341.7 | Mehmel, M Ueber die Struktur von Halloysit und Metahalloysit. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1935, 90, 35-43 |
1501501 | CIF | Mg0.237 Nb0.473 O3 Pb Ti0.29 | C 1 m 1 | 5.6968; 5.682; 4.0132 90; 90.125; 90 | 129.904 | Singh, Akhilesh Kumar; Pandey, Dhananjai; Zaharko, Oksana Powder neutron diffraction study of phase transitions in and a phase diagram of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3 Physical Review B, 2006, 74, 1-18 |
1501502 | CIF | Mg0.237 Nb0.473 O3 Pb Ti0.29 | C 1 m 1 | 5.7025; 5.6778; 4.0087 90; 90.24; 90 | 129.791 | Singh, Akhilesh Kumar; Pandey, Dhananjai; Zaharko, Oksana Powder neutron diffraction study of phase transitions in and a phase diagram of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3 Physical Review B, 2006, 74, 1-18 |
1501503 | CIF | Mg0.25 Nb0.5 O3 Pb Ti0.25 | C 1 m 1 | 5.7022; 5.6815; 4.0167 90; 90.248; 90 | 130.128 | Singh, Akhilesh Kumar; Pandey, Dhananjai; Zaharko, Oksana Powder neutron diffraction study of phase transitions in and a phase diagram of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3 Physical Review B, 2006, 74, 1-18 |
1501504 | CIF | Mg0.25 Nb0.5 O3 Pb Ti0.25 | C 1 m 1 | 5.6987; 5.687; 4.0211 90; 90.135; 90 | 130.32 | Singh, Akhilesh Kumar; Pandey, Dhananjai; Zaharko, Oksana Powder neutron diffraction study of phase transitions in and a phase diagram of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3 Physical Review B, 2006, 74, 1-18 |
1501505 | CIF | Mg0.25 Nb0.5 O3 Pb Ti0.25 | C 1 m 1 | 5.6969; 5.6889; 4.0215 90; 90.109; 90 | 130.333 | Singh, Akhilesh Kumar; Pandey, Dhananjai; Zaharko, Oksana Powder neutron diffraction study of phase transitions in and a phase diagram of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3 Physical Review B, 2006, 74, 1-18 |
1501506 | CIF | Mg0.25 Nb0.5 O3 Pb Ti0.25 | C 1 m 1 | 5.6952; 5.6903; 4.022 90; 90.083; 90 | 130.34 | Singh, Akhilesh Kumar; Pandey, Dhananjai; Zaharko, Oksana Powder neutron diffraction study of phase transitions in and a phase diagram of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3 Physical Review B, 2006, 74, 1-18 |
1501512 | CIF | Mg0.237 Nb0.473 O3 Pb Ti0.29 | C 1 m 1 | 5.6951; 5.6813; 4.0138 90; 90.136; 90 | 129.868 | Singh, Akhilesh Kumar; Pandey, Dhananjai Evidence for MB and MC phases in the morphotropic phase boundary region of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3: a Rietveld study Physical Review B, 2003, 67, 1-12 |
1510885 | CIF | B3 Ca3.999 Ce0.03 Er0.021 O10 Y0.75 Yb0.2 | C 1 m 1 | 8.063; 15.995; 3.5231 90; 101.15; 90 | 445.79 | Chizhikov, V.I.; Yu, Y.M.; Kuz'micheva, G.M.; Ageev, A.Yu.; Panyutin, V.L.; Rybakov, V.B. Growth and X-ray diffraction study of Y Ca4 O (B O3)3: Ce,Er,Yb crystals Neorganicheskie Materialy, 2001, 37, 1235-1245 |
1510886 | CIF | B3 Ca3.999 Er0.021 O10 Y0.73 Yb0.25 | C 1 m 1 | 8.065; 15.998; 3.5243 90; 101.17; 90 | 446.105 | Chizhikov, V.I.; Panyutin, V.L.; Kuz'micheva, G.M.; Ageev, A.Yu.; Rybakov, V.B.; Yu, Y.M. Growth and X-ray diffraction study of Y Ca4 O (B O3)3: Ce,Er,Yb crystals Neorganicheskie Materialy, 2001, 37, 1235-1245 |
1510887 | CIF | B3 Ca4 La O10 | C 1 m 1 | 8.183; 16.11; 3.623 90; 101.36; 90 | 468.256 | Belokoneva, E.L.; Mill', B.V.; Ershova, G.I. Crystallization and crystal structure of La Ca4 O (B O3)3 Zhurnal Neorganicheskoi Khimii, 2003, 48, 5-7 |
1510888 | CIF | B3 Ca4 Lu O10 | C 1 m 1 | 8.055; 15.986; 3.511 90; 101.12; 90 | 443.614 | Ilyukhin, A.B.; Dzhurinskii, B.F. Crystal structures of double oxoborates LnCa4O(BO3)3 (Ln=Gd, Tb, Lu) and Eu2CaO(BO3)2 Zhurnal Neorganicheskoi Khimii, 1993, 38, 917-920 |
1510889 | CIF | B3 Ca4 O10 Tb | C 1 m 1 | 8.089; 16.034; 3.5511 90; 101.24; 90 | 451.74 | Dzhurinskii, B.F.; Ilyukhin, A.B. Crystal structures of double oxoborates Ln Ca4 O (B O3)3 (Ln= Gd, Tb, Lu) and Eu2 Ca O (B O3)2 Zhurnal Neorganicheskoi Khimii, 1993, 38, 917-920 |
1510890 | CIF | B3 Ca4 O10 Y0.85 Yb0.15 | C 1 m 1 | 8.062; 15.996; 3.524 90; 101.16; 90 | 445.861 | Chizhikov, V.I.; Kuz'micheva, G.M.; Yu, Y.M.; Panyutin, V.L.; Rybakov, V.B.; Ageev, A.Yu. Growth and X-ray diffraction study of Y Ca4 O (B O3)3: Ce,Er,Yb crystals Neorganicheskie Materialy, 2001, 37, 1235-1245 |
1510891 | CIF | B3 Ca4.084 O9.96 Y0.916 | C 1 m 1 | 8.069; 16.005; 3.5275 90; 101.17; 90 | 446.927 | Yu, Y.M.; Ageev, A.Yu.; Kuz'micheva, G.M.; Panyutin, V.L.; Chizhikov, V.I.; Rybakov, V.B. Growth and X-ray diffraction study of Y Ca4 O (B O3)3: Ce,Er,Yb crystals Neorganicheskie Materialy, 2001, 37, 1235-1245 |
1511069 | CIF | B Co3 O7 P | C 1 m 1 | 9.774; 12.688; 4.9057 90; 119.749; 90 | 528.19 | Kniep, R.; Kizilyalli, M.; Stucky, G.D.; Yilmaz, A.; Bu Xianhui Cobalt borate phosphate, Co3 (B P O7), synthesis and characterization Journal of Solid State Chemistry, 2001, 156, 281-285 |
1511425 | CIF | B18 K8 Se18 | C 1 m 1 | 16.2878; 41.617; 9.7876 90; 109.592; 90 | 6250.41 | Hammerschmidt, A.; Krebs, B.; Doech, M.; Lindemann, A. K8 (B12 (B Se3)6): a novel selenoborato-closo- dodecaborate with different anion substitution patterns Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 1249-1255 |
1511697 | CIF | B8 O38 Y16.86 | C 1 m 1 | 18.1662; 3.6516; 13.9775 90; 119.75; 90 | 805 | You, L.-P.; Su, M.-Z.; Zhou, S.; Yang, L.-Q.; Lin, J.-H.; Yao, G.-Q. Structure and luminescent properties of Y17.33 (B O3)4 (B2 O5)2 O16 Journal of Solid State Chemistry, 1997, 134, 158-163 |
1518091 | CIF | Bi7 Cs3 Se12 | C 1 m 1 | 27.733; 4.177; 13.286 90; 107.9; 90 | 1465 | Cordier, Gerhard; Schafer, Herbert; Schwidetzky, Christoph 0n Cs3Bi7Se12, a new layer selenidobismutate (III) Revue de Chimie Minerale, 1985, 22, 676-683 |
1518112 | CIF | F11 O Tl U3 | C 1 m 1 | 14.051; 8.106; 8.389 90; 90; 90 | 955.5 | Hsini, Sifeddine; Caignol, Elisabeth; Metin, Jacques; Avignant, Daniel; Cousseins, Jean-Claude Structure cristalline de l'oxyfluorure TlU3OF11 Revue de Chimie Minerale, 1986, 23, 35-47 |
1521045 | CIF | O3 Pb Ti0.46 Zr0.54 | C 1 m 1 | 5.76907; 5.74266; 4.089 90; 90.497; 90 | 135.463 | Frantti, J.; Rundlof, H.; Lappalainen, J.; Ivanov, S.; Eriksson, S.; Lantto, V.; Nishio, S.; Kakihana, M. Neutron diffraction studies of Pb (Zrx Ti1-x) O3 ceramics Japanese Journal of Applied Physics, Part 1, 2000, 39, 5697-5703 |
1521480 | CIF | Fe0.5 Nb0.5 O3 Pb | C 1 m 1 | 5.674; 5.663; 4.013 90; 89.84; 90 | 128.945 | Lampis, N.; Geddo Lehmann, A.; Sciau, P. Rietveld refinements of the paraelectric and ferroelectric structures of Pb Fe0.5 Nb0.5 O3 Journal of Physics: Condensed Matter, 1999, 11, 3489-3500 |
1521482 | CIF | Fe0.5 O3 Pb Ta0.5 | C 1 m 1 | 5.6687; 5.661; 4.0083 90; 89.853; 90 | 128.628 | Lampis, N.; Sciau, P.; Geddo Lehmann, A. Rietveld refinement of the paraelectric and ferroelectric structures of Pb Fe0.5 Ta0.5 O3 Journal of Physics: Condensed Matter, 2000, 12, 2367-2378 |
1522870 | CIF | Al3 Mo | C 1 m 1 | 16.396; 3.594; 8.386 90; 101.88; 90 | 483.579 | Schuster, J.C.; Ipser, H. The Al - Al8 Mo3 section of the binary system aluminum- molybdenum Metallurgical Transactions A: Physical Metallurgy and Materials Science, 1991, 22, 1729-1738 |
1524390 | CIF | Cu0.85 O5 V2 | C 1 m 1 | 11.78; 3.691; 8.876 90; 111.8; 90 | 358.329 | Galy, J.; Lavaud, D.; Casalot, A.; Hagenmuller, P. Bronzes oxygenes de vanadium de formule Cux V2 O5: Structure cristalline des phases Cux V2 O5 -beta et Cux V2 O5 - epsilon Journal of Solid State Chemistry, 1970, 2, 531-543 |
1524991 | CIF | H4 Mg2 Ni | C 1 m 1 | 6.497; 6.414; 6.601 90; 93.23; 90 | 274.638 | Noreus, D.; Werner, P.E. The crystal structure of the low temperature phase Mg2 Ni H4 (LT) Materials Research Bulletin, 1981, 16, 199-206 |
1525908 | CIF | O3 Pb Ti0.48 Zr0.52 | C 1 m 1 | 5.7154; 5.704; 4.1378 90; 90.493; 90 | 134.89 | Dmowski, W.; Egami, T.; Davies, P.K.; Farber, L. Structure of Pb (Zr, Ti) O3 near the morphotropic phase boundary AIP Conference Proceedings, 2001, 582, 33-44 |
1526149 | CIF | O3 Pb Ti0.48 Zr0.52 | C 1 m 1 | 5.72204; 5.70957; 4.13651 90; 90.498; 90 | 135.136 | Noheda, B.; Gonzalo, J.A.; Cross, L.E.; Shirane, G.; Park, S.-E.; Guo, R.; Cox, D.E. Tetragonal-to-monoclinic phase transition in a ferroelectric perovskite: the structure of Pb Zr0.52 Ti0.48 O3 Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2000, 61, 8687-8695 |
1526328 | CIF | Ba0.2 Ca1.2 H25.94 K3.1 Mn1.78 Nb0.2 O65.8 Si16 Ti7.8 | C 1 m 1 | 14.365; 13.887; 7.814 90; 117.36; 90 | 1384.42 | Rastsvetaeva, R.K.; Pekov, I.V.; Nekrasov, Yu.V. Crystal structure and microtwinning of a calcium-rich analog of labuntsovite Kristallografiya, 2001, 46, 415-417 |
1526403 | CIF | Cu2.324 O11 V4 | C 1 m 1 | 15.309; 3.61; 7.335 90; 101.84; 90 | 396.748 | Rozier, P.; Satto, C.; Galy, J. The vanadium oxide bronze Cu2.33-x V4 O11. Solid state chemistry, XRD Solid State Sciences, 2000, 2, 595-605 |
1526666 | CIF | C4 H16 N9 O16 Y | C 1 m 1 | 6.773; 20.866; 6.551 90; 102.98; 90 | 902.167 | Song, J.; Kang, B.; Ning, B.; Hu, R. Preparation, crystal structure and thermal decomposition process of (Y (NTO)2 NO3 (H2 O)5) * 2(H2 O) Thermochimica Acta, 2000, 352, 111-115 |
1526858 | CIF | Al O4 P | C 1 m 1 | 18.46799; 31.97029; 16.67589 90; 90; 90 | 9845.9 | de Onate Martinez, J.; McCusker, L.B.; Baerlocher, C. Characterization and structural analysis of differently prepared samples of dehydrated VPI-5 Microporous and Mesoporous Materials, 2000, 34, 99-113 |
1526859 | CIF | Al O4 P | C 1 m 1 | 18.52179; 32.12469; 8.40026 90; 90; 90 | 4998.21 | de Onate Martinez, J.; McCusker, L.B.; Baerlocher, C. Characterization and structural analysis of differently prepared samples of dehydrated VPI-5 Microporous and Mesoporous Materials, 2000, 34, 99-113 |
1528301 | CIF | Er3 F10 K | C 1 m 1 | 14.088; 8.1378; 28.28 90; 109.27; 90 | 3060.52 | Aleonard, S.; Guitel, J.C.; Roux, M.T. Structure cristalline de la phase beta-K Er3 F10 Journal of Solid State Chemistry, 1978, 24, 331-344 |
1529027 | CIF | C1.35 D2.7 O12 Si6 | C 1 m 1 | 10.43638; 15.01832; 8.85531 90; 105.739; 90 | 1335.92 | Yang, X.; Toby, B.H.; Camblor, M.A.; Lee, Y.; Olson, D.H. Propene adsorption sites in zeolite ITQ-12: a combined synchrotron x-ray and neutron diffraction study J. Phys. Chem. B, 2005, 109, 7894-7899 |
1529433 | CIF HKL | F3 K3 O3 W | C 1 m 1 | 8.7355; 8.6901; 6.1569 90; 135.167; 90 | 329.53 | M.S. Molokeev; S.V. Misyul; V.D. Fokina; A.G. Kocharova; K.S. Aleksandrov Structure transformations during phase transitions in the K3WO3F3 oxyfluoride Physics of the Solid State, 2011, 53, 834-839 |
1529566 | CIF | Cs H4 Li O5 S | C 1 m 1 | 11.927; 5.67; 4.828 90; 109.26; 90 | 308.225 | Archer, C.; Durand, J.; Cot, L.; Galigne, J.L. Sur quelques sulfites de cations monovalents; etude structurale de Li Cs O3 (H2 O)2 Canadian Journal of Chemistry, 1979, 57, 899-903 |
1529767 | CIF | Ca5 H4 K2 Na4 O34 Si12 | C 1 m 1 | 18.74; 7.19; 12.33 90; 112; 90 | 1540.38 | Chiragov, M.I.; Belov, N.V.; Mamedov, H.S. Crystal structure of canasite Ca5 Na4 K2 (Si12 O30) ((O H), F)4 Doklady Akademii Nauk SSSR, 1969, 185, 672-674 |
1530020 | CIF | Bi Li5 O5 | C 1 m 1 | 9.964; 4.148; 5.9409 90; 109.49; 90 | 231.472 | Greaves, C.; Katib, S.M.A. The Structures of Li5 Bi O5 and Li5 Sb O5 From Powder Neutron Diffraction Materials Research Bulletin, 1989, 24, 973-980 |
1530422 | CIF | B12 H34 O13 U | C 1 m 1 | 14.513; 9.641; 9.705 90; 117.76; 90 | 1201.63 | Mikhailov, Yu.N.; Kanishcheva, A.S.; Kuznetsov, N.T.; Zemskova, L.A.; Mistryukov, V.E.; Solntsev, K.A. A Preliminary determination of the crystal structures of uranyl complexes with neutral ligands and closoborate anions (U O2 (C O (N H2)2)5 (B10 H10) (C O (N H2)2)2 and (U O2 (H2 O)5) (B12 H12) (H2 O)6 Zhurnal Neorganicheskoi Khimii, 1982, 27, 2343-2347 |
1530436 | CIF | Na4 Ni7 O24 P6 | C 1 m 1 | 10.55; 13.985; 6.398 90; 104.87; 90 | 912.359 | Moring, J.; Kostiner, E. The crystal structure of Na4 Ni7 (P O4)6 Journal of Solid State Chemistry, 1986, 62, 105-111 |
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