Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
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7222309 | CIF | Cu2 Ho O8 Ru Sr2 | P 4/m m m | 3.82665; 3.82665; 11.5341 90; 90; 90 | 168.897 | Aguirre, M.H.; Ruiz-Bustos, R.; Alario-Franco, M.A. Crystal structure and microdomain texture in Ru Sr2 Ho Cu2 O8 Journal of Materials Chemistry, 2003, 13, 1156-1160 |
7222310 | CIF | Bi Ni O3 | P -1 | 5.3852; 5.6498; 7.7078 91.9529; 89.8097; 91.5411 | 234.29 | Ishiwata, S.; Azuma, M.; Takata, M.; Takano, M.; Nishibori, E.; Sakata, M.; Kato, K. High pressure synthesis, crystal structure and physical properties of a new Ni(II) perovskite Bi Ni O3 Journal of Materials Chemistry, 2002, 12, 3733-3737 |
7222311 | CIF | Fe0.45 Ga0.05 O3 Sr Ta0.5 | P m -3 m | 3.9657; 3.9657; 3.9657 90; 90; 90 | 62.368 | Cussen, E.J.; Battle, P.D. The influence of structural disorder on the magnetic properties of Sr2 Fe1-x Gax Ta O6 (0 <= x <= 1) Journal of Materials Chemistry, 2003, 13, 1210-1214 |
7222312 | CIF | Ga O6 Sr2 Ta | F m -3 m | 7.89232; 7.89232; 7.89232 90; 90; 90 | 491.602 | Cussen, E.J.; Battle, P.D. The influence of structural disorder on the magnetic properties of Sr2 Fe1-x Gax Ta O6 (0 <= x <= 1) Journal of Materials Chemistry, 2003, 13, 1210-1214 |
7222314 | CIF | C2 H15 N2 O17 P4 V2 | I 41 | 6.3881; 6.3881; 16.608 90; 90; 90 | 677.736 | Calin, N.; Serre, C.; Sevov, S.C. V(III) V(IV) (H P O4)4 * enH * (H2 O): a mixed-valence vanadium phosphate with an open framework Journal of Materials Chemistry, 2003, 13, 531-534 |
7222336 | CIF | Ba Fe0.8 Ir0.2 O2.932 | P 63/m m c | 5.71167; 5.71167; 14.0768 90; 90; 120 | 397.705 | Jordan, N.A.; Battle, P.D.; Kilcoyne, S.; Sloan, J.; Manuel, P. Structural chemistry and magnetic properties of 6H and 15R hexagonal perovskites Ba Irx Fe1-x O3-d Journal of Materials Chemistry, 2003, 13, 2617-2625 |
7222337 | CIF | Ba Fe0.425 Ir0.575 O3 | P 63/m m c | 5.74145; 5.74145; 14.2308 90; 90; 120 | 406.259 | Jordan, N.A.; Battle, P.D.; Manuel, P.; Sloan, J.; Kilcoyne, S. Structural chemistry and magnetic properties of 6H and 15R hexagonal perovskites Ba Irx Fe1-x O3-d Journal of Materials Chemistry, 2003, 13, 2617-2625 |
7222338 | CIF | Ba Fe0.73 Ir0.27 O2.95 | R -3 m :H | 5.73047; 5.73047; 35.5495 90; 90; 120 | 1010.98 | Jordan, N.A.; Battle, P.D.; Sloan, J.; Kilcoyne, S.; Manuel, P. Structural chemistry and magnetic properties of 6H and 15R hexagonal perovskites Ba Irx Fe1-x O3-d Journal of Materials Chemistry, 2003, 13, 2617-2625 |
7222339 | CIF | Ba Ir0.3 Mn0.7 O3 | R -3 m :H | 5.69926; 5.69926; 21.2778 90; 90; 120 | 598.542 | Jordan, N.A.; Battle, P.D. Structural chemistry and magnetic properties of hexagonal perovskites Ba Irx Mn1-x O3 , x = 0.3, 0.4, 0.5 Journal of Materials Chemistry, 2003, 13, 2220-2226 |
7222340 | CIF | Ba Ir0.4 Mn0.6 O3 | R -3 m :H | 5.71037; 5.71037; 21.4005 90; 90; 120 | 604.342 | Jordan, N.A.; Battle, P.D. Structural chemistry and magnetic properties of hexagonal perovskites Ba Irx Mn1-x O3 , x = 0.3, 0.4, 0.5 Journal of Materials Chemistry, 2003, 13, 2220-2226 |
7222341 | CIF | Ba Ir0.5 Mn0.5 O3 | R -3 m :H | 5.72021; 5.72021; 21.5196 90; 90; 120 | 609.802 | Jordan, N.A.; Battle, P.D. Structural chemistry and magnetic properties of hexagonal perovskites Ba Irx Mn1-x O3 , x = 0.3, 0.4, 0.5 Journal of Materials Chemistry, 2003, 13, 2220-2226 |
7222342 | CIF | O3 V Yb | P n m a | 5.5662; 7.5446; 5.232 90; 90; 90 | 219.717 | Munoz, A.; Alonso, J.A.; Casais, M.T.; Martinez-Lope, M.J.; Martinez, J.L.; Fernandez-Diaz, M.T. Structural and magnetic transition in Yb V O3: a neutron diffraction study Journal of Materials Chemistry, 2003, 13, 1234-1240 |
7222388 | CIF | Fe O6.1 Pb2 Re | F d -3 m :2 | 10.382; 10.382; 10.382 90; 90; 90 | 1119.03 | Ramesha, K.; Eichhorn, B.; Sebastian, L.; Gopalakrishnan, J. Pb2 Fe Re O6: new defect pyrochlore oxide with a geometrically frustrated Fe/Re sublattice Journal of Materials Chemistry, 2003, 13, 2011-2014 |
7222391 | CIF | N7 Si4 Sr Y | P 63 m c | 5.997; 5.997; 9.659 90; 90; 120 | 300.837 | Fang, C.M.; Li, Y.Q.; Hintzen, H.T.; de With, G. Crystal and electronic structure of the novel nitrides M Y Si4 N7 (M= Sr, Ba) with peculiar N Si4 coordination Journal of Materials Chemistry, 2003, 13, 1480-1483 |
7222392 | CIF | Ba N7 Si4 Y | P 63 m c | 6.021; 6.021; 9.803 90; 90; 120 | 307.77 | Fang, C.M.; de With, G.; Li, Y.Q.; Hintzen, H.T. Crystal and electronic structure of the novel nitrides M Y Si4 N7 (M= Sr, Ba) with peculiar N Si4 coordination Journal of Materials Chemistry, 2003, 13, 1480-1483 |
7222393 | CIF | Mn0.6 Nd0.8 O4 Rh0.4 Sr1.2 | I 4/m m m | 3.86107; 3.86107; 12.42856 90; 90; 90 | 185.283 | Gallon, D.J.; Battle, P.D.; Rosseinsky, M.J.; Blundell, S.J.; Coldea, A.I.; Steer, C. Synthesis and characterization of Sr1.2 Nd0.8 Mn0.6 Rh0.4 O4 Journal of Materials Chemistry, 2003, 13, 1166-1172 |
7222394 | CIF | Fe Li O4 P | P n m a | 10.227; 6.0048; 4.6918 90; 90; 90 | 288.129 | Garcia-Moreno, O.; Gallardo Amores, J.M.; Alvarez-Vega, M.; Sanjuan, M.L.; Garcia-Jaca, J.; Garcia-Alvarado, F.; Amador, U. Influence of the structure on the electrochemical performance of lithium transition metal phosphates as cathodic materials in rechargeable lithium batteries: a new high-pressure form of Li M P O4 (M = Fe and Ni) Journal of Materials Chemistry, 2001, 13, 1570-1576 |
7222395 | CIF | Fe Li O4 P | C m c m | 5.523; 8.2565; 6.1583 90; 90; 90 | 280.822 | Garcia-Moreno, O.; Garcia-Alvarado, F.; Alvarez-Vega, M.; Garcia-Jaca, J.; Gallardo Amores, J.M.; Amador, U.; Sanjuan, M.L. Influence of the structure on the electrochemical performance of lithium transition metal phosphates as cathodic materials in rechargeable lithium batteries: a new high-pressure form of Li M P O4 (M = Fe and Ni) Journal of Materials Chemistry, 2001, 13, 1570-1576 |
7222396 | CIF | Li Ni O4 P | C m c m | 5.358; 8.1272; 6.1241 90; 90; 90 | 266.677 | Garcia-Moreno, O.; Alvarez-Vega, M.; Amador, U.; Garcia-Alvarado, F.; Garcia-Jaca, J.; Gallardo Amores, J.M.; Sanjuan, M.L. Influence of the structure on the electrochemical performance of lithium transition metal phosphates as cathodic materials in rechargeable lithium batteries: a new high-pressure form of Li M P O4 (M = Fe and Ni) Journal of Materials Chemistry, 2001, 13, 1570-1576 |
7222412 | CIF | Li2.81 O4 Ru1.04 | P 1 2/a 1 | 5.1057; 5.8545; 5.1062 90; 110.039; 90 | 143.391 | Alexander, A.; Grey, C.P.; Burley, J.C.; Battle, P.D.; Gallon, D.J.; Kim Sang-Hwan Structural and magnetic properties of Li3 Ru O4 Journal of Materials Chemistry, 2003, 13, 2612-2616 |
7222413 | CIF | Be6 Fe8 O24 S2 Si6 | P -4 3 n | 8.2028; 8.2028; 8.2028 90; 90; 90 | 551.933 | Armstrong, J.A.; Dann, S.E.; Neumann, K.; Marco, J.F. Synthesis, structure and magnetic behaviour of the danalite family of minerals, Fe8 (Be Si O4)6 X2 (X = S, Se, Te) Journal of Materials Chemistry, 2003, 13, 1229-1233 |
7222414 | CIF | Be6 Fe8 O24 Se2 Si6 | P -4 3 n | 8.2838; 8.2838; 8.2838 90; 90; 90 | 568.445 | Armstrong, J.A.; Dann, S.E.; Marco, J.F.; Neumann, K. Synthesis, structure and magnetic behaviour of the danalite family of minerals, Fe8 (Be Si O4)6 X2 (X = S, Se, Te) Journal of Materials Chemistry, 2003, 13, 1229-1233 |
7222415 | CIF | Be6 Fe8 O24 Si6 Te2 | P -4 3 n | 8.3685; 8.3685; 8.3685 90; 90; 90 | 586.061 | Armstrong, J.A.; Dann, S.E.; Neumann, K.; Marco, J.F. Synthesis, structure and magnetic behaviour of the danalite family of minerals, Fe8 (Be Si O4)6 X2 (X = S, Se, Te) Journal of Materials Chemistry, 2003, 13, 1229-1233 |
7222417 | CIF | Na0.88 Ni1.02 O28 P7 Sr9.04 | R 3 c :H | 10.6755; 10.6755; 38.9339 90; 90; 120 | 3842.69 | Belik, A.A.; Izumi, F.; Ikeda, T.; Malakho, A.P.; Lazoryak, B.I. Strontium phosphates with beta-(Ca3 (P O4)2)-type structures: Sr9 Ni Li (P O4)7, Sr9.04 Ni1.02 Na0.88 (P O4)7 and Sr9.08 Ni1.04 K0.76 (P O4)7 Journal of Materials Chemistry, 2002, 12, 3803-3808 |
7222418 | CIF | K0.76 Ni1.04 O28 P7 Sr9.08 | R 3 c :H | 10.7128; 10.7128; 38.9492 90; 90; 120 | 3871.11 | Belik, A.A.; Izumi, F.; Ikeda, T.; Malakho, A.P.; Lazoryak, B.I. Strontium phosphates with beta-(Ca3 (P O4)2)-type structures: Sr9 Ni Li (P O4)7, Sr9.04 Ni1.02 Na0.88 (P O4)7 and Sr9.08 Ni1.04 K0.76(P O4)7 Journal of Materials Chemistry, 2002, 12, 3803-3808 |
7222424 | CIF | Mn5 Si3 | ? | 6.8943; 11.9131; 4.80742 90; 90; 90.268 | 394.84 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
7222425 | CIF | Mn5 Si3 | ? | 6.8939; 11.9135; 4.80731 90; 90; 90.262 | 394.82 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
7222426 | CIF | Mn5 Si3 | ? | 6.8929; 11.9152; 4.8061 90; 90; 90.222 | 394.72 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
7222428 | CIF | Mn5 Si3 | ? | 6.8924; 11.9164; 4.80483 90; 90; 90.2 | 394.63 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
7222429 | CIF | Mn5 Si3 | C c m m | 6.90396; 11.89561; 4.7959 90; 90; 90 | 393.872 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
7222430 | CIF | Mn5 Si3 | C c m m | 6.90198; 11.90062; 4.7964 90; 90; 90 | 393.966 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
7222431 | CIF | Mn5 Si3 | C c m m | 6.899; 11.90799; 4.7973 90; 90; 90 | 394.114 | Gottschilch, Michael; Gourdon, Olivier; Persson, Joerg; de la Cruz, Clarina; Petricek, Vaclav; Brueckel, Thomas Study of the antiferromagnetism of Mn5Si3: an inverse magnetocaloric effect material Journal of Materials Chemistry, 2012, 22, 15275 |
7222433 | CIF | Cu0.15 O6 Ru0.85 Sr2 Y | P 1 21/n 1 | 5.75961; 5.7787; 8.14843 90; 90.325; 90 | 271.2 | Parkinson, N.G.; Wu Mawkuen; Hatton, P.D.; Howard, J.A.K.; Ritter, C.; Chien Fan, Z. Crystal and magnetic structures of A2 Y Ru1-x Cux O6 with A = Sr, Ba and x = 0.05 to 0.15 Journal of Materials Chemistry, 2003, 13, 1468-1474 |
7222434 | CIF | Ba2 Cu0.1 O6 Ru0.9 Y | F m -3 m | 8.31696; 8.31696; 8.31696 90; 90; 90 | 575.299 | Parkinson, N.G.; Hatton, P.D.; Howard, J.A.K.; Chien Fan, Z.; Ritter, C.; Wu Mawkuen Crystal and magnetic structures of A2 Y Ru1-x Cux O6 with A = Sr, Ba and x = 0.05 to 0.15 Journal of Materials Chemistry, 2003, 13, 1468-1474 |
7222435 | CIF | Li Mn0.3 Ni0.7 O2 | R -3 m :H | 2.88467; 2.88467; 14.25943 90; 90; 120 | 102.76 | Kobayashi, H.; Sakaebe, H.; Kageyama, H.; Tatsumi, K.; Arachi, Y.; Kamiyama, T. Changes in the structure and physical properties of the solid solution Li Ni1-x Mnx O2 with variation in its composition Journal of Materials Chemistry, 2003, 13, 590-595 |
7222436 | CIF | Li Mn0.4 Ni0.6 O2 | R -3 m :H | 2.89166; 2.89166; 14.28997 90; 90; 120 | 103.48 | Kobayashi, H.; Kageyama, H.; Sakaebe, H.; Tatsumi, K.; Arachi, Y.; Kamiyama, T. Changes in the structure and physical properties of the solid solution Li Ni1-x Mnx O2 with variation in its composition Journal of Materials Chemistry, 2003, 13, 590-595 |
7222706 | CIF | Eu Ge Pt | P 21 3 | 6.5463; 6.5463; 6.5463 90; 90; 90 | 280.535 | Poettgen, R.; Muellmann, R.; Kremer, R.K.; Mosel, B.D.; Schnelle, W. Magnetic, electrical and 151Eu Moessbauer properties of Eu Pt Ge Journal of Materials Chemistry, 1996, 6, 635-638 |
7222942 | CIF | Cr0.738 Fe0.262 O4 V | C 1 2/m 1 | 9.8139; 8.8615; 6.837 90; 107.67; 90 | 566.533 | Attfield, J.P.; Cheetham, A.K.; Johnson, D.C.; Novet, T. Magnetic frustration,spirals and short range order in CrxFe1-xVO4-I solid solutions Journal of Materials Chemistry, 1991, 1, 867-873 |
7222955 | CIF | O5 U V | P b c m | 4.1231; 12.3641; 7.2071 90; 90; 90 | 367.407 | Dickens, P.G.; Stuttard, G.P.; Ball, R.G.J.; Hull, S.; Powell, A.V.; Patat, S. Powder neutron diffraction study of the mixed uraniumvanadium oxides Cs2(UO2)2(V2O8) and UVO5 Journal of Materials Chemistry, 1992, 2, 161-166 |
7222956 | CIF | Cs2 O12 U2 V2 | P 1 21/a 1 | 10.521; 8.4369; 7.308 90; 106.08; 90 | 623.312 | Dickens, P.G.; Stuttard, G.P.; Ball, R.G.J.; Patat, S.; Hull, S.; Powell, A.V. Powder neutron diffraction study of the mixed uraniumvanadium oxides Cs2(UO2)2(V2O8) and UVO5 Journal of Materials Chemistry, 1992, 2, 161-166 |
7222960 | CIF | Cu La0.8 O2.64 Sr0.2 | R -3 c :H | 5.495; 5.495; 13.234 90; 90; 120 | 346.065 | Currie, D.B.; Weller, M.T. Structure of La0.8 Sr0.2 Cu O2.64 Powder neutron diffraction on very small sample volumes Journal of Materials Chemistry, 1991, 1, 295-296 |
7222994 | CIF | Ca Li O4 P | P 3 1 c | 7.5247; 7.5247; 9.9657 90; 90; 120 | 488.671 | Lightfoot, P.; Pienkowski, M.C.; Bruce, P.G.; Abrahams, I. Synthesis and structure of LiCaPO4 by combined x-ray and neutron powder diffraction Journal of Materials Chemistry, 1991, 1, 1061-1063 |
7223685 | CIF | C2 Fe0.88 Sc | P 4/n m m :1 | 3.284; 3.284; 7.488 90; 90; 90 | 80.756 | Poettgen, R.; Jeitschko, W.; Wortmann, U.; Danebrock, M.E. Crystal structures and physical properties of the ternary carbides Sc T1-x C2 (T= Fe, Co, Ni) Journal of Materials Chemistry, 1992, 2, 633-637 |
7223698 | CIF | C Cu O5 Sr2 | P 4/m m m | 3.9033; 3.9033; 7.4925 90; 90; 90 | 114.154 | Narendra Babu, T.G.; Fish, D.J.; Greaves, C. Synthesis, structure and electric properties of Sr2CuO2 (CO3), an oxide carbonate related to perovskite Journal of Materials Chemistry, 1991, 1, 677-679 |
7223704 | CIF | Mn10 Mo24 Na10 O165 P17 | I 41/a c d :2 | 27.1925; 27.1925; 41.0974 90; 90; 90 | 30388.7 | du Peloux, C.; Mialane, P.; Dolbecq, A.; Marrot, J.; Riviere, E.; Secheresse, F. Synthesis, crystal structure and magnetic properties of new molybdenum(V) phosphates containing Mn(2+) or Co(2+) with three-dimensional structures directed by the nature of the transition metal Journal of Materials Chemistry, 2001, 11, 3392-3396 |
7223709 | CIF | Co3 Mo12 Na12 O102 P8 | C 1 2/m 1 | 28.1613; 14.2131; 12.998 90; 114.79; 90 | 4723.16 | du Peloux, C.; Mialane, P.; Secheresse, F.; Marrot, J.; Riviere, E.; Dolbecq, A. Synthesis, crystal structure and magnetic properties of new molybdenum(V) phosphates containing Mn(2+) or Co(2+) with three-dimensional structures directed by the nature of the transition metal Journal of Materials Chemistry, 2001, 11, 3392-3396 |
7223710 | CIF | Cu La14 O36.5 V6 | P -1 | 9.7375; 9.9167; 10.3684 88.083; 64.141; 87.847 | 900.163 | Gopalakrishnan, J.; Eichhorn, B.W.; Gonen, Z.S.; Fettinger, J.C.; Chang, K.-S.; Mandal, T.K.; Takeuchi, I.; Greene, R.L. Synthesis and structure of La14 V6 Cu O36.5: a transparent Cu(I) vanadate containing (O Cu O)(3-) sticks Journal of Materials Chemistry, 2002, 12, 3839-3842 |
7223711 | CIF | H8 N O15 P3 V2 Zn | P 1 21/n 1 | 10.7451; 9.1941; 13.2112 90; 103.66; 90 | 1268.24 | le Fur, E.; Pena, O.; Pivan, J.Y. Magnetic susceptibility and crystal structure of the new oxovanadium phosphate (N H4) Zn (H2 O) (V O)2 (P O4)2 (H2 P O4) Journal of Materials Chemistry, 2002, 12, 132-136 |
7223823 | CIF | Bi1.12 Ge O5 Y0.88 | P b c a | 5.341; 15.232; 11.084 90; 90; 90 | 901.729 | Cascales, C.; Campa, J.A.; Gutierrez Puebla, E.; Monge, M.A.; Ruiz-Valero, C.; Rasines, I. New rare-earth (Y, Yb) bismuth(III) germanates. An initial study of a promising series Journal of Materials Chemistry, 2002, 12, 3626-3630 |
7223830 | CIF | Cu0.66 Eu Te2 | P 4/n m m :2 | 4.481; 4.481; 10.26 90; 90; 90 | 206.014 | Patschke, R.; Kanatzidis, M.G.; Brazis, P.; Kannewurf, C.R. Cu0.66 Eu Te2, K Cu2 Eu Te4 and Na0.2 Ag2.8 Eu Te4: compounds with modulated square Te nets Journal of Materials Chemistry, 1999, 9, 2293-2296 |
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