Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1000308 | CIF | La Ni O3 | R -3 c :H | 5.4535; 5.4535; 13.1014 90; 90; 120 | 337.4 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000309 | CIF | La Ni O3 | R -3 c :H | 5.4536; 5.4536; 13.1062 90; 90; 120 | 337.6 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000310 | CIF | La Ni O3 | R -3 c :H | 5.4573; 5.4573; 13.1462 90; 90; 120 | 339.1 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000311 | CIF | Ni O3 Pr | P b n m | 5.4155; 5.3884; 7.6164 90; 90; 90 | 222.3 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000312 | CIF | Ni O3 Pr | P b n m | 5.4133; 5.3828; 7.6227 90; 90; 90 | 222.1 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000313 | CIF | Ni O3 Pr | P b n m | 5.4115; 5.3763; 7.6163 90; 90; 90 | 221.6 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000314 | CIF | Ni O3 Pr | P b n m | 5.4193; 5.3801; 7.6263 90; 90; 90 | 222.4 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000315 | CIF | Nd Ni O3 | P b n m | 5.3824; 5.3861; 7.6066 90; 90; 90 | 220.5 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000316 | CIF | Nd Ni O3 | P b n m | 5.3836; 5.3863; 7.6078 90; 90; 90 | 220.6 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000317 | CIF | Nd Ni O3 | P b n m | 5.3879; 5.3797; 7.6058 90; 90; 90 | 220.5 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000318 | CIF | Nd Ni O3 | P b n m | 5.3891; 5.3816; 7.6101 90; 90; 90 | 220.7 | García-Muñoz, J. L.; Rodríguez-Carvajal, J.; Lacorre, P.; Torrance, J. B. Neutron-diffraction study of RNiO~3~ (R= La, Pr, Nd, Sm): Electronically induced structural changes across the metal-insulator transition Physical Review B: Condensed Matter and Materials Physics, 1992, 46, 4414-4425 |
| 1000319 | CIF | Ba3 F12 O2 Ta2 | P 42/n m c :2 | 5.5063; 5.5063; 21.0295 90; 90; 90 | 637.6 | Crosnier-Lopez, M P; Laligand, Y; Fourquet, J L A new oxyfluoride Ba~3~Ta~2~O~2~F~12~: structural approach European Journal of Solid State Inorganic Chemistry, 1993, 30, 155-163 |
| 1000320 | CIF | C3 Ba2 Ce F O9 | P 1 21/m 1 | 13.365; 5.097; 6.638 90; 106.45; 90 | 433.7 | Mercier, N; Leblanc, M Crystal growth and structures of rare earth fluorocarbonates: I. Structures of BaSm(CO~3~)~2~F and Ba~3~La~2~(CO~3~)~5~F~2~: revision of the corresponding huanghoite and cebaite type structures European Journal of Solid State Inorganic Chemistry, 1993, 30, 195-205 |
| 1000321 | CIF | C Ba Cu F2 O3 | C m c m | 4.889; 8.539; 9.588 90; 90; 90 | 400.3 | Mercier, N; Leblanc, M Existence of 3d transition metal fluorocarbonates: synthesis, characterization of BaM(CO~3~)F~2~ (M=Mn, Cu) and crystal structure of BaCu(CO~3~)F~2~ European Journal of Solid State Inorganic Chemistry, 1993, 30, 217-225 |
| 1000322 | CIF | F2 Ga4 H6 O16 P3 | I 41/a :2 | 13.455; 13.455; 18.902 90; 90; 90 | 3422 | Loiseau, T; Ferey, G Oxyfluorinated microporous compounds: III. Synthesis and crystal structure of a new gallophosphate: Ga~4~P~3~O~12~F~2~(OH)~2~(H~2~O)~2~, 0.5 DABCO European Journal of Solid State Inorganic Chemistry, 1993, 30, 369-381 |
| 1000323 | CIF | Ba10 Cu12 F47 Fe | C 1 2/m 1 | 15.447; 11.638; 11.809 90; 109.92; 90 | 1995.9 | Renaudin, J; Ferey, G; de Kozak, A; Samouel, M; Gredin, P Complex copper(II) fluorides: XIV. The average crystal structure ofBa~10~Cu~12~FeF~47~ European Journal of Solid State Inorganic Chemistry, 1993, 30, 401-411 |
| 1000324 | CIF | Ba4 F12 Nb2 O3 | C 1 2/c 1 | 22.672; 13.075; 14.996 90; 114.234; 90 | 4053.6 | Crosnier-Lopez, M P; Fourquet, J L Synthesis and crystal structure of Ba~4~Nb~2~O~3~F~12~ Journal of Solid State Chemistry, 1993, 103, 131-138 |
| 1000325 | CIF | F5 Fe K2 | P b a m | 7.3591; 23.0897; 5.7054 90; 90; 90 | 969.5 | Fourquet, J L; Duroy, H K~2~FeF~5~: synthesis and crystal structure of a new form Journal of Solid State Chemistry, 1993, 103, 353-358 |
| 1000326 | CIF | F12 In2 Li4 Zn | P b c n | 4.7496; 17.606; 5.0617 90; 90; 90 | 423.3 | Maguer, J J; Courbion, G A tri-$-alpha-PbO~2~ related structure:Li~4~ZnIn~2~F~12~ Journal of Solid State Chemistry, 1993, 103, 466-471 |
| 1000327 | CIF | Bi0.5 O7 P2 Ta0.5 | P a -3 | 8.253; 8.253; 8.253 90; 90; 90 | 562.1 | Oyetola, S; Verbaere, A; Guyomard, D; Crosnier, M P; Piffard, Y; Tournoux, M New ZrP~2~O~7~-like diphosphates of either mixed (M^III^~1/2~M'^V^~1/2~) cations (M=Sb,Bi,Nd,Eu;M'=Sb, Nb,Ta) or M'^V^ cations (M'=Ta,Nb):synthesis and structure European Journal of Solid State Inorganic Chemistry, 1991, 28, 23-36 |
| 1000328 | CIF | O7 P1.901 Ta0.899 | P a -3 | 8.109; 8.109; 8.109 90; 90; 90 | 533.2 | Oyetola, S; Verbaere, A; Guyomard, D; Crosnier, M P; Piffard, Y; Tournoux, M New ZrP~2~O~7~-like diphosphates of either mixed (M^III^~1/2~M'^V^~1/2~) cations (M=Sb,Bi,Nd,Eu;M'=Sb, Nb,Ta) or M'^V^ cations (M'=Ta,Nb):synthesis and structure European Journal of Solid State Inorganic Chemistry, 1991, 28, 23-36 |
| 1000329 | CIF | Al Ba3 F9 | P n m a | 10.063; 5.567; 14.88 90; 90; 90 | 833.6 | Renaudin, J; Ferey, G; de Kozak, A; Samouel, M Crystal structure of a polytypic form of Ba~3~AlF~9~(form Ib) European Journal of Solid State Inorganic Chemistry, 1991, 28, 373-381 |
| 1000330 | CIF | C2 Ba2 F3 O6 Y | P b c n | 9.458; 6.966; 11.787 90; 90; 90 | 776.6 | Mercier, N; Leblanc, M Synthesis and crystal structure of fluorocarbonates Ba~2~M(CO~3~)~2~F~3~ (M=Y,Gd) European Journal of Solid State Inorganic Chemistry, 1991, 28, 727-735 |
| 1000331 | CIF | C2 Ba2 F3 Gd O6 | P b c n | 9.513; 6.978; 11.864 90; 90; 90 | 787.6 | Mercier, N; Leblanc, M Synthesis and crystal structure of fluorocarbonates Ba~2~M(CO~3~)~2~F~3~ (M=Y,Gd) European Journal of Solid State Inorganic Chemistry, 1991, 28, 727-735 |
| 1000332 | CIF | Ba F4 O Ti | P b c m | 5.1719; 13.7555; 5.5178 90; 90; 90 | 392.5 | Crosnier, M P; Fourquet, J L Synthesis and crystal structure of BaTiOF~4~ European Journal of Solid State Inorganic Chemistry, 1992, 29, 199-206 |
| 1000333 | CIF | Li2 O7 P2 Pd | I m m a | 12.5858; 7.4955; 5.8116 90; 90; 90 | 548.2 | Laligant, Y Crystal structure of Li~2~PdP~2~O~7~ solved from X-ray powder diffraction European Journal of Solid State Inorganic Chemistry, 1992, 29, 239-247 |
| 1000334 | CIF | Li2 O6 Te Ti | P n n 2 | 5.0743; 4.9067; 8.4083 90; 90; 90 | 209.4 | Crosnier, M P; Delarue, E; Choisnet, J; Fourquet, J L Li^+^-H^+^ exchange on Li~2~TiTeO~6~ European Journal of Solid State Inorganic Chemistry, 1992, 39, 321-332 |
| 1000335 | CIF | H1.68 Li0.32 O6 Te Ti | P n n m | 5.0098; 4.702; 8.6118 90; 90; 90 | 202.9 | Crosnier, M P; Delarue, E; Choisnet, J; Fourquet, J L Li^+^-H^+^ exchange on Li~2~TiTeO~6~ European Journal of Solid State Inorganic Chemistry, 1992, 39, 321-332 |
| 1000336 | CIF | H1.68 Li0.32 O6 Te Ti | P 42 n m | 4.6861; 4.6861; 8.8707 90; 90; 90 | 194.8 | Crosnier, M P; Delarue, E; Choisnet, J; Fourquet, J L Li^+^-H^+^ exchange on Li~2~TiTeO~6~ European Journal of Solid State Inorganic Chemistry, 1992, 39, 321-332 |
| 1000337 | CIF | Na2 O7 P2 Pd | C 1 2/c 1 | 14.693; 5.8551; 7.922 90; 114.11; 90 | 622.1 | Laligant, Y Structure determination of Na~2~PdP~2~O~7~ from X-ray powder diffraction European Journal of Solid State Inorganic Chemistry, 1992, 29, 83-94 |
| 1000338 | CIF | Ba3 Cr4 F20 Na2 | P 1 21/n 1 | 7.262; 20.668; 5.431 90; 90.76; 90 | 815.1 | Abjean, P; Leblanc, M; De, Pape R; Ferey, G Structure of Na~2~ Ba~3~ Cr~4~ F~20~ Acta Crystallographica C (39,1983-), 1985, 41, 1696-1698 |
| 1000339 | CIF | K2 Nb2 O14 Si4 | P 4 b m | 8.7404; 8.7404; 8.136 90; 90; 90 | 621.5 | Crosnier, M P; Guyomard, D; Verbaere, A; Piffard, Y; Tournoux, M The potassium niobyl cyclotetrasilicate K~2~(NbO)~2~Si~4~O~12~ Journal of Solid State Chemistry, 1992, 98, 128-132 |
| 1000340 | CIF | Cr5 F26 Na3 Sr4 | C 1 2/c 1 | 19.959; 7.45; 29.291 90; 111.244; 90 | 4059.4 | Hemon, A; Courbion, G New pentamers of octahedra: structural and magnetic characterization of Na~3~Sr~4~Cr~5~F~26~ Journal of Solid State Chemistry, 1992, 98, 358-365 |
| 1000341 | CIF | Ba2 F6 O Ti | C 1 c 1 | 11.446; 9.304; 7.252 90; 126.67; 90 | 619.4 | Crosnier, M P; Fourquet, J L Synthesis and crystal structure of a new acentric oxyfluoride: Ba~2~TiOF~6~ Journal of Solid State Chemistry, 1992, 99, 355-363 |
| 1000342 | CIF | Ba F5.5 H1.5 Nb O1.5 | P a -3 | 9.9259; 9.9259; 9.9259 90; 90; 90 | 977.9 | Crosnier-Lopez, M P; Duroy, H; Fourquet, J L BaNbF~7-x~(OH)~x~: preparation and crystal structure European Journal of Solid State Inorganic Chemistry, 1993, 30, 549-556 |
| 1000343 | CIF | C4 F La2 Na3 O12 | P 63/m m c | 5.083; 5.083; 23.034 90; 90; 120 | 515.4 | Mercier, N; Taulelle, F; Leblanc, M Growth, structure, NMR characterization of a new fluorocarbonate Na~3~La~2~(CO~3~)~4~F European Journal of Solid State Inorganic Chemistry, 1993, 30, 609-617 |
| 1000344 | CIF | Cr H12 N4 O4 Pd | I 41/a m d :2 | 7.3177; 7.3177; 15.289 90; 90; 90 | 818.7 | Laligant, Y On the first palladium chromate: crystal structure of Pd(NH~3~)~4~(CrO~4~) European Journal of Solid State Inorganic Chemistry, 1993, 30, 681-688 |
| 1000345 | CIF | Ba3 F8 O4 V2 | P n n m | 9.945; 10.277; 9.673 90; 90; 90 | 988.6 | Crosnier-Lopez, M P; Duroy, H; Fourquet, J L Ba~3~V~2~O~4~F~8~:(V~4~(O,F)~20~)^8-^ tetrameric groups of octahedra inserted in a tridimensional network of (FBa~4~) tetrahedra Zeitschrift fuer Anorganische und Allgemeine Chemie, 1993, 619, 1597-1602 |
| 1000346 | CIF | Cu3 Fe4 O24 V6 | P -1 | 6.6; 8.048; 9.759 106.08; 103.72; 102.28 | 461.9 | Lafontaine, M A; Greneche, J M; Laligant, Y; Ferey, G $-beta-Cu~3~Fe~4~(VO~4~)~6~: Structural study and relationships; physical properties Journal of Solid State Chemistry, 1994, 108, 1-10 |
| 1000347 | CIF | Nd4 Ni3 O8 | I 4/m m m | 3.9171; 3.9171; 25.307 90; 90; 90 | 388.3 | Lacorre, Ph Passage from T-type to T'-type arrangement by reducing R~4~Ni~3~O~10~ to R~4~Ni~3~O~8~ (R=La, Pr, Nd) Journal of Solid State Chemistry, 1992, 97, 495-500 |
| 1000348 | CIF | Al F5 Mn | C m c m | 3.5837; 9.854; 9.537 90; 90; 90 | 336.8 | Ferey, G; Leblanc, M; Mercier, A - M A new refinement of the crystal structure of MnAlF~5~: new structural correlations with MnCrF~5~ and Cr~2~F~5~ using orthogonal subcell twinning Journal of Solid State Chemistry, 1993, 102, 9-19 |
| 1000349 | CIF | F0.5 Ga H4.43 N0.93 O4.57 P | P 21 21 21 | 9.593; 9.742; 9.981 90; 90; 90 | 932.8 | Ferey, G; Loiseau, T; Lacorre, P; Taulelle, F Oxyfluorinated microporous compounds. I. Crystal structure of (NH~4~)~0.93~(H~3~O)~0.07~GaPO~4~(OH)~0.5~ F~0.5~: reexamination of the structure of AlPO~4~-CJ2 Journal of Solid State Chemistry, 1993, 105, 179-190 |
| 1000350 | CIF | Al F0.675 H4.205 N0.88 O4.445 P | P 21 21 21 | 9.416; 9.563; 9.933 90; 90; 90 | 894.4 | Ferey, G; Loiseau, T; Lacorre, P; Taulelle, F Oxyfluorinated microporous compounds. I. Crystal structure of (NH~4~)~0.93~(H~3~O)~0.07~GaPO~4~(OH)~0.5~ F~0.5~: reexamination of the structure of AlPO~4~-CJ2 Journal of Solid State Chemistry, 1993, 105, 179-190 |
| 1000351 | CIF | F0.45 Fe1.21 H0.92 O4.55 P | I 41/a m d :2 | 5.184; 5.184; 13.04 90; 90; 90 | 350.4 | Loiseau, Th; Lacorre, Ph; Calage, Y; Greneche, J M; Ferey, G Crystal structure and magnetic study of a new iron(III) phosphate, Fe~1.21~PO~4~X (X=F, OH, H~2~O), isostructural with 3MgSO~4~ . Mg(OH)~2~ . H~2~O Journal of Solid State Chemistry, 1993, 105, 417-427 |
| 1000352 | CIF | Ba3 F12 H4 Nb2 O4 | C m c 21 | 22.633; 7.804; 7.748 90; 90; 90 | 1368.5 | Crosnier-Lopez, M P; Fourquet, J L Ba~3~Nb~2~O~2~F~12~.2H~2~O: Synthesis and crystal structure Journal of Solid State Chemistry, 1993, 105, 92-99 |
| 1000353 | CIF | Ba5 F20 H Nb3 O3 | P 63/m | 11.935; 11.935; 7.852 90; 90; 120 | 968.6 | Crosnier-Lopez, M P; Duroy, H; Fourquet, J L Ba~5~Nb~3~O~3~F~18~(HF~2~): synthesis and crystal structure Journal of Solid State Chemistry, 1993, 107, 211-217 |
| 1000354 | CIF | Cu6 Fe0.9 O19 V6 | R -3 :H | 12.9399; 12.9399; 7.1275 90; 90; 120 | 1033.5 | Permer, L; Laligant, Y; Ferey, G; Calage, Y Crystal structure, magnetic, and Moessbauer studies of Cu~6~Fe~0.9~V~6~O~19~: a compound with relaxation effect Journal of Solid State Chemistry, 1993, 107, 539-546 |
| 1000355 | CIF | Cr Cu P2 S6 | P 1 c 1 | 5.935; 10.282; 13.368 90; 106.78; 90 | 781 | Maisonneuve, V; Cajipe, V B; Payen, C Low-temperature neutron powder diffraction study of CuCrP~2~S~6~: observation of an ordered, antipolar copper sublattice Chemistry of Materials (1,1989-, 1993, 5, 758-760 |
| 1000356 | CIF | H12 Mo N4 O4 Pd | I 41/a m d :2 | 7.4618; 7.4618; 15.5565 90; 90; 90 | 866.2 | Laligant, Y Crystal structure of the first palladium ammine molybdate: Pd(NH~3~)~4~(MoO~4~) European Journal of Solid State Inorganic Chemistry, 1993, 30, 1017-1023 |
| 1000357 | CIF | Ca0.5 Cu2 Hg0.4 O7 Pr1.1 Sr2 | P m m m | 3.8463; 3.8018; 12.154 90; 90; 90 | 177.7 | Hervieu, M; Van Tendeloo, G; Maignan, A; Michel, C; Goutenoire, F; Raveau, B New 1212-type superconductors with a T~c~ up to 85K in the system Hg-Pr- Sr-Ca-Cu-O Physica C (Amsterdam) (152,1988-), 1993, 216, 264-272 |
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