Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1000408 | CIF | Al F4 Tl | I 1 2/a 1 | 5.1376; 5.1301; 12.7822 90; 90.119; 90 | 336.9 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Tl Al F4: DSC investigations and structures determinations by neutron powder profile refinement Journal of Physics C, 1987, 20, 2885-2900 |
| 1000409 | CIF | Al F4 Tl | I 1 2/a 1 | 5.1138; 5.0912; 12.6878 90; 90.289; 90 | 330.3 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Tl Al F4: DSC investigations and structures determinations by neutron powder profile refinement Journal of Physics C, 1987, 20, 2885-2900 |
| 1000410 | CIF | Al F4 Tl | I 1 2/a 1 | 5.101; 5.0745; 12.6324 90; 90.355; 90 | 327 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Tl Al F4: DSC investigations and structures determinations by neutron powder profile refinement Journal of Physics C, 1987, 20, 2885-2900 |
| 1000411 | CIF | Ba2 Cu5 F14 | C 1 2/c 1 | 18.17; 6.652; 10.328 90; 117.1; 90 | 1111.3 | de Kozak, A.; Samouel, M.; Renaudin, J.; Ferey, G. Fluorures complexes de cuivre II. V. Structure cristalline de α-Ba~2~Cu~5~F~14~ Revue de Chimie Minerale, 1986, 23, 352-361 |
| 1000412 | CIF | C2 H16 Al F5 N6 O2 | P n m a | 20.04999; 7.291; 7.834 90; 90; 90 | 1145.2 | Fourquet, J L; Plet, F; De Pape, R La structure cristalline de (C (N H2)3)2 Al F5 (H2 O)2 Revue de Chimie Minerale, 1986, 23, 183-190 |
| 1000413 | CIF | C3 H18 F6 Fe N9 | P a -3 | 14.13; 14.13; 14.13 90; 90; 90 | 2821.2 | Fourquet, J L; Plet, F; Calage, Y; DePape, R Crystal structure and magnetic characterization of (C (N H2)3)3 Fe F6 Journal of Solid State Chemistry, 1987, 69, 76-80 |
| 1000414 | CIF | La2 Ni O4 | P n c b :1 | 5.468; 5.535; 12.547 90; 90; 90 | 379.7 | Odier, P; Leblanc, M; Choisnet, J Structural characterization of an orthorhombic form of La Ni O4 Materials Research Bulletin, 1986, 21, 787-796 |
| 1000415 | CIF | Ba2 Cu2.2 Hg1.5 O8 Pr1.3 | I 4/m m m | 3.9236; 3.9236; 28.993 90; 90; 90 | 446.3 | Martin, C; Hervieu, M; Van Tendeloo, G; Goutenoire, F; Michel, C; Maignan, A; Raveau, B A mercury based cuprate with the 2212 structure: Hg2-x (Cu, Pr)x Ba2 Pr Cu2 O8-d Solid State Communications, 1995, 93, 53-56 |
| 1000416 | CIF | Ca3.06 O9 Tl3.94 | C 1 2/m 1 | 11.118; 3.341; 12.287 90; 102.88; 90 | 444.9 | Goutenoire, F; Caignaert, V; Hervieu, M; Raveau, B The calcium thallate Ca3 Tl4 O9, an intergrowth of the Ca Tl2 O4 and Ca2 Tl2 O5 structures, member n=1.5 of the series Can Tl2 On+3 Journal of Solid State Chemistry, 1995, 119, 134-141 |
| 1000417 | CIF | Al Ca F6 Na | P 3 2 1 | 8.9295; 8.9295; 5.0642 90; 90; 120 | 349.7 | Hemon, A; Courbion, G The Na F - Ca F2 - Al F3 system: structures of $-beta- Na Ca Al F6 and Na4 Ca4 Al7 F33 Journal of Solid State Chemistry, 1990, 84, 153-164 |
| 1000418 | CIF | Al7 Ca4 F33 Na4.032 | I m -3 m | 10.781; 10.781; 10.781 90; 90; 90 | 1253.1 | Hemon, A; Courbion, G The Na F - Ca F2 - Al F3 system: structures of $-beta- Na Ca Al F6 and Na4 Ca4 Al7 F33 Journal of Solid State Chemistry, 1990, 84, 153-164 |
| 1000419 | CIF | Al Cd F6 Na | P n m a | 12.506; 3.6406; 9.902 90; 90; 90 | 450.8 | Hemon, A; Courbion, G Na Cd Al F6: a new structure with (Al F5)n(2n-) chains and "independent F(-)" Journal of Solid State Chemistry, 1990, 86, 249-254 |
| 1000420 | CIF | Cr2 F5 | C 1 2/c 1 | 7.7526; 7.5228; 7.4477 90; 124.081; 90 | 359.8 | Lacorre, P; Ferey, G; Pannetier, J The magnetic structure of Cr2 F5 Journal of Solid State Chemistry, 1992, 96, 227-236 |
| 1000421 | CIF | Ba F4 Zn | C m c 21 | 4.1974; 14.546; 5.8391 90; 90; 90 | 356.5 | Lapasset, J; Bordallo, H N; Almairac, R; Nouet, J Crystal structures of barium zincate fluoride, Ba Zn F4 at 295 and 113 K Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 934-935 |
| 1000422 | CIF | Ba F4 Zn | C m c 21 | 4.1843; 14.496; 5.8253 90; 90; 90 | 353.3 | Lapasset, J; Bordallo, H N; Almairac, R; Nouet, J Crystal structures of barium zincate fluoride, Ba Zn F4 at 295 and 113 K Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 934-935 |
| 1000423 | CIF | Cs2 O15 Si6 Zr | C 1 2/m 1 | 26.60999; 7.506; 11.602 90; 107.43; 90 | 2210.9 | Jolicart, G; Leblanc, M; Morel, B; Dehaudt, Ph; Dubois, S Hydrothermal synthesis and structure determination of Cs2 Zr Si6 O15 European Journal of Solid State Inorganic Chemistry, 1996, 33, 647-657 |
| 1000424 | CIF | F34 Fe7 Pb7 | C 1 2/m 1 | 16.375; 11.233; 7.615 90; 102.67; 90 | 1366.6 | Pierrard, A; de Kozak, A; Gredin, P; Renaudin, J The crystal structure of Pb7 Fe(II) Fe(III)6 F34: a new jarlite-type compound Zeitschrift fuer Anorganische und Allgemeine Chemie, 1996, 622, 1200-1204 |
| 1000425 | CIF | Cs F5 Pd2 | I m m a | 6.473; 7.853; 10.718 90; 90; 90 | 544.8 | Ruchaud, N; Grannec, J; Tressaud, A; Ferey, G Magnetic structure of Cs Pd2 F5 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1995, 621, 1958-1962 |
| 1000426 | CIF | Cu4 Fe1.12 H2 O19.6 Pb2.88 V4 | P n m a | 7.525; 5.9; 9.64 90; 90; 90 | 428 | Permer, L; Laligant, Y; Ferey, G Crystal structure of (Pb2.8 Fe1.2) Cu4 O1.6 (V O4)4 (O H)2 ; structural relationships with mineral gamagarite European Journal of Solid State Inorganic Chemistry, 1993, 30, 383-392 |
| 1000427 | CIF | Bi2 O11 Te4 | P 1 21/n 1 | 6.9909; 7.9593; 18.89629 90; 95.176; 90 | 1047.2 | Rossell, H. J.; Leblanc, M.; Ferey, G.; Bevan, D. J. M.; Simpson, D. J.; Taylor, M. R. On the crystal structure of Bi2Te4O11 Locality: synthetic Australian Journal of Chemistry, 1992, 45, 1415-1425 |
| 1000428 | CIF | Ba0.86 Ca2 In6 O12 | P 63/m | 9.888; 9.888; 3.217 90; 90; 120 | 272.4 | Baldinozzi, G; Goutenoire, F; Hervieu, M; Suard, E; Grebille, D Incommensurate modulated disorder in Ba0.85 Ca2.15 In6 O12 Acta Crystallographica B (39,1983-), 1996, 52, 780-789 |
| 1000429 | CIF | Ba0.83 Ca2.1 In6 O12 | P 3 | 9.888; 9.888; 3.217 90; 90; 120 | 272.4 | Baldinozzi, G; Goutenoire, F; Hervieu, M; Suard, E; Grebille, D Incommensurate modulated disorder in Ba0.85 Ca2.15 In6 O12 Acta Crystallographica B (39,1983-), 1996, 52, 780-789 |
| 1000430 | CIF | F2 Fe O4 P Sr | P 1 21/n 1 | 5.207; 12.216; 7.037 90; 103; 90 | 436.1 | Le Meins, J-M; Hemon-Ribaud, A; Laligant, Y; Courbion, G A new fluorophosphate with a laueite-type structural unit: synthesis, TEM study and crystal structure of Sr Fe P O4 F2 European Journal of Solid State Inorganic Chemistry, 1997, 34, 391-404 |
| 1000431 | CIF | Fe2 O13 V4 | P 1 21/c 1 | 8.3125; 9.4055; 14.5768 90; 102.231; 90 | 1113.8 | Permer, L; Laligant, Y Crystal structure of the tetrapolyvanadate Fe2 V4 O13 European Journal of Solid State Inorganic Chemistry, 1997, 34, 41-52 |
| 1000432 | CIF | Fe Li O4 Sn | P m c n | 3.066; 5.066; 9.874 90; 90; 90 | 153.4 | Lacorre, P; Hervieu, M; Pannetier, J; Choisnet, J; Raveau, B Neutron diffraction study of Li1+x (Li2x/3 Fe1-x Sn1+x/3) O4, a nonstoichiometric ramsdellite and its transition to a double hexagonal close packed structure for x = 0 Journal of Solid State Chemistry, 1983, 50, 196-203 |
| 1000433 | CIF | Fe0.75 Li1.417 O4 Sn1.083 | P m c n | 3.074; 5.116; 9.881 90; 90; 90 | 155.4 | Lacorre, P; Hervieu, M; Pannetier, J; Choisnet, J; Raveau, B Neutron diffraction study of Li1+x (Li2x/3 Fe1-x Sn1+x/3) O4, a nonstoichiometric ramsdellite and its transition to a double hexagonal close packed structure for x = 0 Journal of Solid State Chemistry, 1983, 50, 196-203 |
| 1000434 | CIF | Fe Li O4 Sn | P 63 m c | 6.012; 6.012; 9.776 90; 90; 120 | 306 | Lacorre, P; Hervieu, M; Pannetier, J; Choisnet, J; Raveau, B Neutron diffraction study of Li1+x (Li2x/3 Fe1-x Sn1+x/3) O4, a nonstoichiometric ramsdellite and its transition to a double hexagonal close packed structure for x = 0 Journal of Solid State Chemistry, 1983, 50, 196-203 |
| 1000435 | CIF | Fe2 H9 N O11 P2 | P 1 21/n 1 | 9.8232; 9.7376; 9.8716 90; 102.803; 90 | 920.8 | Cavellec, M; Riou, D; Ferey, G Synthetic spheniscidite Acta Crystallographica C (39,1983-), 1994, 50, 1379-1381 |
| 1000436 | CIF | La0.597 Li0.21 O3 Ti | P 4/m m m | 3.8714; 3.8714; 7.7789 90; 90; 90 | 116.6 | Fourquet, J L; Duroy, H; Crosnier-Lopez, M P Structural and microstructural studies of the series La2/3-x Li3x ( )1/3-2x Ti O3 Journal of Solid State Chemistry, 1996, 127, 283-294 |
| 1000437 | CIF | La0.557 Li0.33 O3 Ti | P 4/m m m | 3.8741; 3.8741; 7.7459 90; 90; 90 | 116.3 | Fourquet, J L; Duroy, H; Crosnier-Lopez, M P Structural and microstructural studies of the series La2/3-x Li3x ( )1/3-2x Ti O3 Journal of Solid State Chemistry, 1996, 127, 283-294 |
| 1000438 | CIF | La0.587 Li0.24 O3 Ti | P 4/m m m | 3.87; 3.87; 7.78 90; 90; 90 | 116.5 | Fourquet, J L; Duroy, H; Crosnier-Lopez, M P Structural and microstructural studies of the series La2/3-x Li3x ( )1/3-2x Ti O3 Journal of Solid State Chemistry, 1996, 127, 283-294 |
| 1000439 | CIF | F4 Fe Rb | P m a b | 7.6651; 7.6316; 6.2789 90; 90; 90 | 367.3 | Moron, M C; Bulou, A; Pique, C; Fourquet, J L Structural phase transitions in Rb Fe F4: I.Powder and single crystal X- ray diffraction study of the room temperature phase Journal of Physics: Condensed Matter, 1990, 2, 8269-8275 |
| 1000440 | CIF | Ba2 Ca H6 O16 P4 | P 1 21/a 1 | 12.3872; 10.2046; 5.4946 90; 100.767; 90 | 682.3 | Toumi, M.; Chabchoub, S.; Smiri-Dogguy, L.; Laligant, Y. Ab-initio powder structure determination of CaBa~2~(HPO~4~)~2~(H~2~PO~4~)~2~: a new phosphate with a M(TΦ~4~)~4~ chain structure European Journal of Solid State and Inorganic Chemistry, 1997, 34, 1249-1257 |
| 1000441 | CIF | F10 Fe2 H2 O Sr2 | C m c a | 7.848; 19.86699; 10.773 90; 90; 90 | 1679.7 | Le Meins, J-M; Hemon-Ribaud, A; Courbion, G Sr2 Fe2 F10 . (H2 O), the first hydrated strontium iron(III) fluoride Acta Crystallographica C (39,1983-), 1997, 53, 1165-1166 |
| 1000442 | CIF | Al2 O3 | P n a 21 | 4.8437; 8.33; 8.9547 90; 90; 90 | 361.3 | Ollivier, Benoist; Retoux, Richard; Lacorre, Philippe; Massiot, Dominique; Férey, Gérard Crystal structure of κ-alumina: an X-ray powder diffraction, TEM and NMR study Journal of Materials Chemistry, 1997, 7, 1049-1056 |
| 1000443 | CIF | F10 H5 O2 Yb3 | F d -3 m :2 | 15.326; 15.326; 15.326 90; 90; 90 | 3599.9 | Maguer, J-J; Crosnier-Lopez, M P; Courbion, G "Chimie douce" synthesis and ab initio structure determination of (H3 O) Yb3 F10 . (H2 O) : a diamond type stacking of U O A8 Journal of Solid State Chemistry, 1997, 128, 42-51 |
| 1000444 | CIF | F10 H2 K O Yb3 | F d -3 m :2 | 15.339; 15.339; 15.339 90; 90; 90 | 3609 | Maguer, J-J; Crosnier-Lopez, M P; Courbion, G "Chimie douce" synthesis and ab initio structure determination of (H3 O) Yb3 F10 . (H2 O) : a diamond type stacking of U O A8 Journal of Solid State Chemistry, 1997, 128, 42-51 |
| 1000445 | CIF | F5 Fe H8 N2 | P n m a | 6.3385; 7.6191; 11.0298 90; 90; 90 | 532.7 | Croguennec, L; Deniard, P; Brec, R; Couzi, M; Sourisseau, C; Fourquet, J L; Calage, Y Structural and spectroscopic evidence for hydrogen bonding induced (N H4)(+) cation ordering in $-beta-(N H4)2 Fe F5 at low temperature Journal of Solid State Chemistry, 1997, 131, 189-197 |
| 1000446 | CIF | F5 Fe H8 N2 | P n m a | 6.3269; 7.6076; 10.9802 90; 90; 90 | 528.5 | Croguennec, L; Deniard, P; Brec, R; Couzi, M; Sourisseau, C; Fourquet, J L; Calage, Y Structural and spectroscopic evidence for hydrogen bonding induced (N H4)(+) cation ordering in $-beta-(N H4)2 Fe F5 at low temperature Journal of Solid State Chemistry, 1997, 131, 189-197 |
| 1000447 | CIF | Ba2 Cl F7 Ni2 | P 1 21/m 1 | 7.602; 5.766; 8.788 90; 106.72; 90 | 368.9 | Fompeyrine, J; Darriet, J; Maguer, J-J; Greneche, J M; Courbion, G; Roisnel, T; Rodriguez-Carvajal, J Magnetic properties and neutron diffraction study of the chlorofluoride series Ba2 M M' F7 Cl (M, M' = Mn, Fe, Co, Ni, Zn) Journal of Solid State Chemistry, 1997, 131, 198-214 |
| 1000448 | CIF | Ba2 Cl F7 Mn Ni | P 1 21/m 1 | 7.746; 5.82; 8.898 90; 106.63; 90 | 384.4 | Fompeyrine, J; Darriet, J; Maguer, J-J; Greneche, J M; Courbion, G; Roisnel, T; Rodriguez-Carvajal, J Magnetic properties and neutron diffraction study of the chlorofluoride series Ba2 M M' F7 Cl (M, M' = Mn, Fe, Co, Ni, Zn) Journal of Solid State Chemistry, 1997, 131, 198-214 |
| 1000449 | CIF | Ba2 Cl Co F7 Fe | P 1 21/m 1 | 7.749; 5.771; 8.95 90; 106.8; 90 | 383.2 | Fompeyrine, J; Darriet, J; Maguer, J-J; Greneche, J M; Courbion, G; Roisnel, T; Rodriguez-Carvajal, J Magnetic properties and neutron diffraction study of the chlorofluoride series Ba2 M M' F7 Cl (M, M' = Mn, Fe, Co, Ni, Zn) Journal of Solid State Chemistry, 1997, 131, 198-214 |
| 1000450 | CIF | C3 Eu Na3 O9 | A m a 2 | 9.942; 11.024; 7.147 90; 90; 90 | 783.3 | Mercier, N; Leblanc, M; Antic-Fidancev, E; Lemaitre-Blaise, M Structural and optical investigations of sodium europium carbonate Na3 Eu (C O3)3 Journal of Solid State Chemistry, 1997, 132, 33-40 |
| 1000451 | CIF | Ba4 F13 H5 Mo2 O6 | P n n m | 16.49699; 8.6939; 11.5174 90; 90; 90 | 1651.9 | Fourquet, J L; Duroy, H; Crosnier-Lopez, M P Synthesis and crystal structure of Ba4 Mo2 O5 F7 (H F2)3.H2 O Zeitschrift fuer Anorganische und Allgemeine Chemie, 1997, 623, 439-443 |
| 1000453 | CIF | Al F4 Rb | P 4/m m m | 3.6586; 3.6586; 6.3061 90; 90; 90 | 84.4 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000454 | CIF | Al F4 Rb | P 4/m b m | 5.1375; 5.1375; 6.2912 90; 90; 90 | 166 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000455 | CIF | Al F4 Rb | P 4/m b m | 5.1227; 5.1227; 6.2815 90; 90; 90 | 164.8 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000456 | CIF | Al F4 Rb | P m m n :2 | 7.2285; 7.2252; 6.2624 90; 90; 90 | 327.1 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000457 | CIF | Al F4 Rb | P m m n :2 | 7.2124; 7.2073; 6.2396 90; 90; 90 | 324.3 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000458 | CIF | C2.25 H10.5 F2 Ga3 N1.5 O12.5 P3 | P 1 21/n 1 | 8.674; 10.19; 16.82599 90; 94.21; 90 | 1483.2 | Loiseau, T; Taulelle, F; Ferey, G Crystal structure and solid-state nuclear magnetic resonance characterization of an oxyfluorinated three-dimensional framework gallophosphate with ULM-4 structural type. Structural relationships with (Ga As O4)-2 Microporous Materials, 1997, 9, 83-93 |
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