Crystallography Open Database
Search results
Result: there are 191 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Nature'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
1008355 | CIF | Ba2.1 Cu3 O6 Y0.9 | P 4/m m m | 3.8715; 3.8715; 11.738 90; 90; 90 | 175.9 | Bordet, P; Chaillout, C; Capponi, J J; Chenavas, J; Marezio, M Crystal structure of Y~0.9~ Ba~2.1~ Cu~3~ O~6~, a compound related to the high-T~c~ superconductor Y Ba~2~ Cu~3~ O~7~. Nature (London), 1987, 327, 687-689 |
1008369 | CIF | Ba4 Cu7 O14.3 Y2 | A m m m | 3.851; 3.869; 50.29 90; 90; 90 | 749.3 | Bordet, P; Chaillout, C; Chenavas, J; Hodeau, J L; Marezio, M; Karpinski, J; Kaldis, E Structure Determination of the new high-temperature Superconductor Y Ba Cu O (2/4/7/14.30) Nature (London), 1988, 334, 596-598 |
1008815 | CIF | Bi O3 Sr | P 1 21/n 1 | 5.948; 6.0951; 8.4854 90; 90.063; 90 | 307.6 | Kazakov, S M; Chaillout, C; Bordet, P; Capponi, J J; Nunez-Regueiro, M; Rysak, A; Tholence, J L; Radaelli, P G; Putilin, S N; Antipov, E V Discovery of a second family of bismuth-oxide-based superconductors Nature (London), 1997, 390, 148-150 |
1008816 | CIF | Bi K0.56 O3 Sr0.44 | I 4/m c m | 5.9416; 5.9416; 8.4394 90; 90; 90 | 297.9 | Kazakov, S M; Chaillout, C; Bordet, P; Capponi, J J; Nunez-Regueiro, M; Rysak, A; Tholence, J L; Radaelli, P G; Putilin, S N; Antipov, E V Discovery of a second family of bismuth-oxide-based superconductors Nature (London), 1997, 390, 148-150 |
1010411 | CIF | Cl5 P | P 4/n :1 | 9.2; 9.2; 7.4 90; 90; 90 | 626.3 | Powell, H M; Clark, D; Wells, A F Crystal Structure of Phosphorus Pentachloride Nature (London), 1940, 145, 149-149 |
1010412 | CIF | Mg2 Si | F m -3 m | 6.391; 6.391; 6.391 90; 90; 90 | 261 | Owen, E A; Preston, G D The atomic structure of two intermetallic compounds Nature (London), 1924, 113, 914-914 |
1010413 | CIF | Cr O3 | C c m m | 8.5; 4.73; 5.72 90; 90; 90 | 230 | Wooster, W A; Wooster, N Crystal Structure of Chromium Trioxide Nature (London), 1931, 127, 782-782 |
1010414 | CIF | Al F3 | P 3 2 1 | 4.93; 4.93; 6.25 90; 90; 120 | 131.6 | Ketelaar, J A A Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and Palladium Nature (London), 1931, 128, 303-303 |
1010415 | CIF | F3 Fe | P 3 2 1 | 5.2; 5.2; 6.66 90; 90; 120 | 156 | Ketelaar, J A A Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and Palladium Nature (London), 1931, 128, 303-303 |
1010416 | CIF | Co F3 | P 3 2 1 | 5.06; 5.06; 6.63 90; 90; 120 | 147 | Ketelaar, J A A Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and Palladium Nature (London), 1931, 128, 303-303 |
1010417 | CIF | F3 Rh | P 3 2 1 | 4.88; 4.88; 6.81 90; 90; 120 | 140.4 | Ketelaar, J A A Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and Palladium Nature (London), 1931, 128, 303-303 |
1010418 | CIF | F3 Pd | P 3 2 1 | 5.05; 5.05; 7.08 90; 90; 120 | 156.4 | Ketelaar, J A A Structure of the Trifluorides of Aluminium, Iron, Cobalt, Rhodium, and Palladium Nature (London), 1931, 128, 303-303 |
1010419 | CIF | Na O3 W | P m -3 m | 3.85; 3.85; 3.85 90; 90; 90 | 57.1 | Haegg, G The Spinels and the Cubic Sodium - Tungsten Bronzes as New Examples of Structures with Vacant Lattice Points Nature (London), 1935, 135, 874-874 |
1010420 | CIF | Na0.35 O3 W | P m -3 m | 3.813; 3.813; 3.813 90; 90; 90 | 55.4 | Haegg, G The Spinels and the Cubic Sodium - Tungsten Bronzes as New Examples of Structures with Vacant Lattice Points Nature (London), 1935, 135, 874-874 |
1010421 | CIF | Bi Br O | P 4/n m m :1 | 3.92; 3.92; 8.11 90; 90; 90 | 124.6 | Bannister, F A Crystal Structure of Bismuth Oxyhalides Nature (London), 1934, 134, 856-857 |
1010422 | CIF | Bi I O | P 4/n m m :1 | 4.09; 4.09; 7.21 90; 90; 90 | 120.6 | Bannister, F A Crystal Structure of Bismuth Oxyhalides Nature (London), 1934, 134, 856-857 |
1010540 | CIF | Br H4 N | P 4/n m m :1 | 6.007; 6.007; 4.035 90; 90; 90 | 145.6 | Ketelaar, J A A Crystal Structure of the Low Temperature Modification of Ammonium Bromide Nature (London), 1934, 134, 250-251 |
1010776 | CIF | C Cl3 F | ; ; ; ; | Wouters, J; De Hemptinne, M Interatomic distances of F C Cl~3~ and F C Br~3~ Nature (London), 1938, 141, 412-413 | ||
1010777 | CIF | Br3 F | ; ; ; ; | Wouters, J; De Hemptinne, M Interatomic distances of F C Cl~3~ and F C Br~3~ Nature (London), 1938, 141, 412-413 | ||
1010780 | CIF | H63 O70 P W12 | 23.281; 23.281; 23.281 90; 90; 90 | 12618.4 | Keggin, J F Structure of the crystals of 12-phosphotungstic acid Nature (London), 1933, 132, 351-351 | |
1010785 | CIF | Fe2 N6 Na | 10.2; 10.2; 10.2 90; 90; 90 | 1061.2 | Keggin, J F; Miles, F D Structures and formulae of the prussian blues and related compounds Nature (London), 1936, 137, 577-578 | |
1010786 | CIF | Fe2 N6 Na2 | 5.1; 5.1; 5.1 90; 90; 90 | 132.7 | Keggin, J F; Miles, F D Structures and formulae of the prussian blues and related compounds Nature (London), 1936, 137, 577-578 | |
1011032 | CIF | Fe3 O4 | F d -3 m :1 | 8.32; 8.32; 8.32 90; 90; 90 | 575.9 | Bragg, W. H. The Structure of Magnetite and the Spinels Nature (London), 1915, 95, 561-561 |
1011173 | CIF | Mg O | F m -3 m | 4.22; 4.22; 4.22 90; 90; 90 | 75.2 | Bragg, W L Crystal structure Nature (London), 1920, 105, 646-648 |
1011174 | CIF | O5 V2 | P m n 21 | 11.48; 4.36; 3.555 90; 90; 90 | 177.9 | Ketelaar, J A A Crystal structure and shape of colloidal particles of vanadium pentoxide Nature (London), 1936, 137, 316-316 |
1011175 | CIF | Bi Cl O | P 4/n m m :1 | 3.89; 3.89; 7.37 90; 90; 90 | 111.5 | Bannister, F A Crystal structure of bismuth oxyhalides Nature (London), 1934, 134, 856-857 |
1011177 | CIF | Al H24 K O20 S2 | P a -3 | 12.18; 12.18; 12.18 90; 90; 90 | 1806.9 | Beevers, C A; Lipson, H Crystal structure of the alums Nature (London), 1934, 134, 327-327 |
1011282 | CIF | F Na | F m -3 m | 4.78; 4.78; 4.78 90; 90; 90 | 109.2 | Bragg, W L Crystal structure of Na F Nature (London), 1920, 105, 646-648 |
1011365 | CIF | Al Sb | F -4 3 m | 6.126; 6.126; 6.126 90; 90; 90 | 229.9 | Owen, E A; Preston, G D The atomic structure of two intermetallic compounds Nature (London), 1924, 113, 914-914 |
1505005 | CIF | C90 H91 N2 O7 P2 | P 21 21 21 | 15.4764; 16.426; 30.614 90; 90; 90 | 7782.5 | Čorić, Ilija; List, Benjamin Asymmetric spiroacetalization catalysed by confined Brønsted acids. Nature, 2012, 483, 315-319 |
1508227 | CIF | C8 Co8 N8 O34 P8 | I -4 2 m | 10.24; 10.24; 9.652 90; 90; 90 | 1012.09 | Feng, Pingyun; Bu, Xianhui; Stucky, Galen D. Hydrothermal syntheses and structural characterization of zeolite analogue compounds based on cobalt phosphate Nature, 1997, 388, 735-741 |
1509135 | CIF | C28 H38 | P 1 21/a 1 | 13.2994; 10.3952; 14.194 90; 105.149; 90 | 1894.13 | Schreiner, Peter R.; Chernish, Lesya V.; Gunchenko, Pavel A.; Tikhonchuk, Evgeniya Yu.; Hausmann, Heike; Serafin, Michael; Schlecht, Sabine; Dahl, Jeremy E. P.; Carlson, Robert M. K.; Fokin, Andrey A. Overcoming lability of extremely long alkane carbon-carbon bonds through dispersion forces. Nature, 2011, 477, 308-311 |
1509136 | CIF | C28 H38 | P 1 21/c 1 | 10.1195; 16.183; 12.5912 90; 109.271; 90 | 1946.45 | Schreiner, Peter R.; Chernish, Lesya V.; Gunchenko, Pavel A.; Tikhonchuk, Evgeniya Yu.; Hausmann, Heike; Serafin, Michael; Schlecht, Sabine; Dahl, Jeremy E. P.; Carlson, Robert M. K.; Fokin, Andrey A. Overcoming lability of extremely long alkane carbon-carbon bonds through dispersion forces. Nature, 2011, 477, 308-311 |
1509137 | CIF | C32 H42 | P -1 | 7.7202; 11.3237; 13.3783 111.818; 91.43; 95.982 | 1077.29 | Schreiner, Peter R.; Chernish, Lesya V.; Gunchenko, Pavel A.; Tikhonchuk, Evgeniya Yu.; Hausmann, Heike; Serafin, Michael; Schlecht, Sabine; Dahl, Jeremy E. P.; Carlson, Robert M. K.; Fokin, Andrey A. Overcoming lability of extremely long alkane carbon-carbon bonds through dispersion forces. Nature, 2011, 477, 308-311 |
1510740 | CIF | B2 Be2 O7 Sr2 | P -6 c 2 | 4.683; 4.683; 15.311 90; 90; 120 | 290.792 | Wu, K.-C.; Zeng, W.-I.; Chen, C.-T.; Wu, B.-C.; Yu, L.-H.; Wang, Y.-B. Design and synthesis of an ultraviolet-transparent nonlinear optical crystal Sr2 Be2 B2 O7 Nature (London), 1995, 373, 322-324 |
1510743 | CIF | B2 La3 N3 Ni2 | I 4/m m m | 3.73; 3.73; 20.67 90; 90; 90 | 287.58 | Jansen, J.; Peck, W.F.jr.; Krajewski, J.J.; Zandbergen, H.W.; Cava, R.J. Structure of the 13 K superconductor La3 Ni2 B2 N3 and the related phase La Ni B N Nature (London), 1994, 372, 759-761 |
1510803 | CIF | B2 Os | P m m n :2 | 4.684; 2.872; 4.096 90; 90; 90 | 55.101 | Stenberg, E.; Aronsson, B.; Aselius, J. Borides of ruthenium, osmium and iridium Nature (London), 1962, 195, 377-378 |
1510818 | CIF | B2 Ru | P m m n :2 | 4.645; 2.865; 4.045 90; 90; 90 | 53.831 | Aselius, J.; Aronsson, B.; Stenberg, E. Borides of ruthenium, osmium and iridium Nature (London), 1962, 195, 377-378 |
1511203 | CIF | B La N Ni | P 4/n m m :2 | 3.73; 3.73; 7.64 90; 90; 90 | 106.295 | Jansen, J.; Krajewski, J.J.; Zandbergen, H.W.; Peck, W.F.jr.; Cava, R.J. Structure of the 13 K superconductor La3 Ni2 B2 N3 and the related phase La Ni B N Nature (London), 1994, 372, 759-761 |
1511344 | CIF | B1.5 Ir | C 1 2/m 1 | 10.52; 2.91; 6.099 90; 91; 90 | 186.681 | Stenberg, E.; Aronsson, B.; Aselius, J. Borides of ruthenium, osmium and iridium Nature (London), 1962, 195, 377-378 |
1511515 | CIF | B4 Si | R -3 m :H | 6.319; 6.319; 12.713 90; 90; 120 | 439.618 | Brosset, C.; Magnusson, B. The Silicon - Boron System Nature (London), 1960, 187, 54-55 |
1513174 | CIF | C231 H700 F20 Ge80 N21 O524 Si112 | P 41 3 2 | 26.51263; 26.51263; 26.51263 90; 90; 90 | 18636.2 | Sun, Junliang; Bonneau, Charlotte; Cantín, Ángel; Corma, Avelino; Díaz-Cabañas, María J.; Moliner, Manuel; Zhang, Daliang; Li, Mingrun; Zou, Xiaodong The ITQ-37 mesoporous chiral zeolite. Nature, 2009, 458, 1154-1157 |
1520216 | CIF | Ba2 Cu Hg O4.1 | P 4/m m m | 3.87766; 3.87766; 9.5073 90; 90; 90 | 142.954 | Putilin, S.N.; Antipov, E.V.; Chmaissem, O.; Marezio, M. Superconductivity at 94 K in Hg Ba2 Cu O4+delta Nature, 1993, 362, 226-228 |
1522696 | CIF | Pt8 Ti | I 4/m m m | 8.312; 8.312; 3.897 90; 90; 90 | 269.241 | Pietrokowsky, P. Novel ordered phase, Pt8 Ti Nature (London), 1965, 206, 291-291 |
1523304 | CIF | Nb0.2 Ti0.8 | C m c m | 3.166; 4.854; 4.652 90; 90; 90 | 71.491 | Brown, A.R.G.; Clark, D.; Eastabrook, J.; Jepson, K.S. The titanium-niobium system Nature (London), 1964, 201, 914-915 |
1523598 | CIF | Re0.22 W0.78 | P m -3 n | 5.0182; 5.0182; 5.0182 90; 90; 90 | 126.37 | Federer, J.I.; Steele, R.M. Identification of a beta-tungsten phase in tungsten- rhenium alloys Nature (London), 1965, 205, 587-588 |
1524454 | CIF | O0.12 U0.88 | P 4/m m m | 5.38; 5.38; 5.55 90; 90; 90 | 160.641 | Gronvold, F.; Haraldsen, H. Oxidation of Uranium Dioxide (U O2) Nature (London), 1948, 162, 69-70 |
1525196 | CIF | Cd0.899592 Na0.161633 | F d -3 m :1 | 30.56; 30.56; 30.56 90; 90; 90 | 28540.4 | Samson, S. Crystal structure of Na Cd2 Nature (London), 1962, 195, 259-262 |
1527571 | CIF | Al1.11 Ca11.76 Cl1.05 O19.82 Si3.33 | I -4 2 m | 10.4714; 10.4714; 8.6171 90; 90; 90 | 944.867 | Ilyukhin, V.V.; Nevskii, N.N.; Howie, R.A.; Bickbau, M.J. Crystal structure of alinite Nature (London), 1977, 269, 397-398 |
1528382 | CIF | As2 Mo | C 1 2 1 | 9.067; 3.3; 7.718 90; 119.35; 90 | 201.289 | Brown, A. Structure data for some arsenic- and germanium-rich compounds of molybdenum Nature (London), 1965, 206, 502-503 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!