Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9012455 | CIF | Xe | F m -3 m | 6.1349; 6.1349; 6.1349 90; 90; 90 | 230.899 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 30 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012456 | CIF | Xe | F m -3 m | 6.1488; 6.1488; 6.1488 90; 90; 90 | 232.472 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 35 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012457 | CIF | Xe | F m -3 m | 6.1542; 6.1542; 6.1542 90; 90; 90 | 233.085 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 40 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012458 | CIF | Xe | F m -3 m | 6.1599; 6.1599; 6.1599 90; 90; 90 | 233.734 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 45 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012459 | CIF | Xe | F m -3 m | 6.166; 6.166; 6.166 90; 90; 90 | 234.429 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 50 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012460 | CIF | Xe | F m -3 m | 6.1727; 6.1727; 6.1727 90; 90; 90 | 235.194 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 55 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012461 | CIF | Xe | F m -3 m | 6.1796; 6.1796; 6.1796 90; 90; 90 | 235.983 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 60 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012462 | CIF | Xe | F m -3 m | 6.1869; 6.1869; 6.1869 90; 90; 90 | 236.82 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 65 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012463 | CIF | Xe | F m -3 m | 6.1945; 6.1945; 6.1945 90; 90; 90 | 237.694 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 70 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012464 | CIF | Xe | F m -3 m | 6.2023; 6.2023; 6.2023 90; 90; 90 | 238.593 | Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 75 K Journal of Chemical Physics, 1962, 37, 3002-3006 |
| 9012465 | CIF | F | P m -3 n | 6.67; 6.67; 6.67 90; 90; 90 | 296.741 | Jordan, T. H.; Streib, W. E.; Lipscomb, W. N. Single-crystal X-ray diffraction study of beta-fluorine Note: T = 50 K Note: beta phase, stable between T = 45.55 K & 53.54 K Journal of Chemical Physics, 1964, 41, 760-764 |
| 9012466 | CIF | Cl2 Fe H4 O2 | C 1 2/m 1 | 7.355; 8.548; 3.637 90; 98.18; 90 | 226.334 | Morosin, B.; Graeber, E. J. Crystal structures of manganese(II) and iron(II) chloride dihydrate Journal of Chemical Physics, 1965, 42, 898-901 |
| 9012467 | CIF | Cl2 H4 Mn O2 | C 1 2/m 1 | 7.409; 8.8; 3.691 90; 98.67; 90 | 237.9 | Morosin, B.; Graeber, E. J. Crystal structures of manganese(II) and iron(II) chloride dihydrate Journal of Chemical Physics, 1965, 42, 898-901 |
| 9012468 | CIF | C6.2 H46 O26 | P m -3 n | 12.03; 12.03; 12.03 90; 90; 90 | 1740.99 | McMullan, R. K.; Jeffery, G. A. Polyhedral clathrate hydrates. IX. Structure of ethylene oxide hydrate Sample: T = -25 C, 6.4C2H4O*46H2O Journal of Chemical Physics, 1965, 42, 2725-2732 |
| 9012469 | CIF | F6 N2 Si | P -3 m 1 | 5.784; 5.784; 4.796 90; 90; 120 | 138.953 | Schlemper, E. O.; Hamilton, W. C. On the structure of trigonal ammonium fluorosilicate Journal of Chemical Physics, 1966, 45, 408-409 |
| 9012470 | CIF | C | P 63/m m c | 2.52; 2.52; 4.12 90; 90; 120 | 22.658 | Bundy, F. P.; Kasper, J. S. Hexagonal diamond-a new form of carbon Journal of Chemical Physics, 1967, 46, 3437-3446 |
| 9012471 | CIF | F2 | C 1 2/m 1 | 5.5; 3.28; 10.01 90; 134.66; 90 | 128.445 | Meyer, L.; Barrett, C. S.; Greer, S. C. Crystal structure of alpha-fluorine Sample: at T = 23 K Note: alpha phase, stable between T = 0 K & 45.6 K Journal of Chemical Physics, 1968, 49, 1902-1907 |
| 9012472 | CIF | Cl2 H12 Ni O6 | C 1 2/m 1 | 10.23; 7.05; 6.57 90; 122.17; 90 | 401.091 | Kleinberg, R. Crystal structure of NiCl2*6H2O at room temperature and 4.2 K by neutron diffraction Sample: T = room temp, X-ray data Journal of Chemical Physics, 1969, 50, 4690-4696 |
| 9012473 | CIF | Cl2 H12 Ni O6 | C 1 2/m 1 | 10.24; 7.04; 6.58 90; 122.23; 90 | 401.259 | Kleinberg, R. Crystal structure of NiCl2*6H2O at room temperature and 4.2 K by neutron diffraction Sample: T = room temp, neutron data Journal of Chemical Physics, 1969, 50, 4690-4696 |
| 9012474 | CIF | Cl2 H12 Ni O6 | C 1 2/m 1 | 10.2; 7.05; 6.5 90; 122.53; 90 | 394.082 | Kleinberg, R. Crystal structure of NiCl2*6H2O at room temperature and 4.2 K by neutron diffraction Sample: T = 4.2 K, neutron data Journal of Chemical Physics, 1969, 50, 4690-4696 |
| 9012475 | CIF | N2 | P 42/m n m | 3.957; 3.957; 5.109 90; 90; 90 | 79.996 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 20.5 K and P = .4068 GPa Note: gamma phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012476 | CIF | N2 | P 63/m m c | 4.05; 4.05; 6.604 90; 90; 120 | 93.81 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 46 K Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012477 | CIF | N2 | P 63/m m c | 3.967; 3.967; 6.496 90; 90; 120 | 88.532 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 46.5 K and P = .1484 GPa Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012478 | CIF | N2 | P 63/m m c | 3.924; 3.924; 6.356 90; 90; 120 | 84.756 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 49 K and P = .2818 GPa Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012479 | CIF | N2 | P 63/m m c | 3.861; 3.861; 6.265 90; 90; 120 | 80.882 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 49 K and P = .4180 GPa Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012480 | CIF | N | P 21 3 | 5.649; 5.649; 5.649 90; 90; 90 | 180.266 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 20 K Note: alpha phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012481 | CIF | N | P 21 3 | 5.495; 5.495; 5.495 90; 90; 90 | 165.922 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 20 K and P = .2690 GPa Note: alpha phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012482 | CIF | N | P 21 3 | 5.433; 5.433; 5.433 90; 90; 90 | 160.369 | Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 19.6 K and P = .3835 GPa Note: alpha phase Journal of Chemical Physics, 1970, 52, 6000-6008 |
| 9012483 | CIF | Ga | I 4/m m m | 2.813; 2.813; 4.452 90; 90; 90 | 35.229 | Bosio, L. Crystal structures of Ga(II) and Ga(III) Sample: at P = 2.8 GPa, T = 298 K Note: structure known as Ga(III) phase Journal of Chemical Physics, 1978, 68, 1221-1223 |
| 9012484 | CIF | Ga | I -4 3 d | 5.951; 5.951; 5.951 90; 90; 90 | 210.751 | Bosio, L. Crystal structures of Ga(II) and Ga(III) Loclailty: synthetic Sample: at P = 2.6 GPa, T = 313 K Note: structure known as Ga(II) phase Journal of Chemical Physics, 1978, 68, 1221-1223 |
| 9012485 | CIF | Ga | C m c m | 2.9; 8.13; 3.17 90; 90; 90 | 74.739 | Curien, H.; Rimsky, A.; Defrain, A. Structure atomique d'une phase cristalline du gallium, instable a la pression atmospherique Locality: synthetic Sample: at T = 256.85 K Bulletin de la Societe Francaise de Mineralogie et de Cristallographie, 1961, 84, 260-264 |
| 9012486 | CIF | P | C m c e | 3.3133; 10.473; 4.374 90; 90; 90 | 151.779 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012487 | CIF | P | C m c e | 3.3121; 10.408; 4.35 90; 90; 90 | 149.955 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = .41 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012488 | CIF | P | C m c e | 3.3105; 10.363; 4.335 90; 90; 90 | 148.72 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = .71 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012489 | CIF | P | C m c e | 3.3109; 10.319; 4.317 90; 90; 90 | 147.491 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.02 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012490 | CIF | P | C m c e | 3.3109; 10.209; 4.302 90; 90; 90 | 145.412 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.27 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012491 | CIF | P | C m c e | 3.3116; 10.26; 4.289 90; 90; 90 | 145.727 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.51 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012492 | CIF | P | C m c e | 3.3114; 10.233; 4.278 90; 90; 90 | 144.962 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.73 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012493 | CIF | P | C m c e | 3.3111; 10.215; 4.266 90; 90; 90 | 144.288 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.93 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012494 | CIF | P | C m c e | 3.3114; 10.189; 4.254 90; 90; 90 | 143.529 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 2.16 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012495 | CIF | P | C m c e | 3.3117; 10.158; 4.243 90; 90; 90 | 142.736 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 2.43 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012496 | CIF | P | C m c e | 3.312; 10.14; 4.229 90; 90; 90 | 142.025 | Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 2.66 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721 |
| 9012497 | CIF | Ce O4 Si | I 41/a m d :2 | 6.9564; 6.9564; 6.1953 90; 90; 90 | 299.8 | Skakle, J. M. S.; Dickson, C. L.; Glasser, F. P. The crystal structures of CeSiO4 and Ca2Ce8(SiO4)6O2 Powder Diffraction, 2000, 15, 234-238 |
| 9012498 | CIF | Ca1.011 Ce3.989 O13 Si3 | P 63/m | 9.4343; 9.4343; 6.8885 90; 90; 120 | 530.976 | Skakle, J. M. S.; Dickson, C. L.; Glasser, F. P. The crystal structures of CeSiO4 and Ca2Ce8(SiO4)6O2 Powder Diffraction, 2000, 15, 234-238 |
| 9012499 | CIF | P | C m c e | 3.3199; 10.3678; 4.3154 90; 90; 90 | 148.536 | Crichton, W. A.; Mezouar, M.; Monaco, G.; Falconi, S. Phosphorus: new in situ powder data from large-volume apparatus Locality: synthetic Sample: at P = 1.2 GPa and T = 1100 K Powder Diffraction, 2003, 18, 155-158 |
| 9012500 | CIF | Li3 O4 P | P m n 21 | 6.115; 5.2394; 4.8554 90; 90; 90 | 155.562 | Keffer, C.; Mighell, A. D.; Mauer, F.; Swanson, H.; Block, S. The crystal structure of twinned low-temperature lithium phosphate Note: dimorphic with lithiophosphate Inorganic Chemistry, 1967, 6, 119-125 |
| 9012501 | CIF | Se | P 31 2 1 | 4.3662; 4.3662; 4.9536 90; 90; 120 | 81.782 | Cherin, P.; Unger, P. The crystal structure of trigonal selenium Inorganic Chemistry, 1967, 6, 1589-1591 |
| 9012502 | CIF | As2 Ni | P a -3 | 5.77; 5.77; 5.77 90; 90; 90 | 192.1 | Munson, R. A. The synthesis of iridium disulfide and nickel diarsenide having the pyrite structure Locality: synthetic Inorganic Chemistry, 1968, 7, 389-390 |
| 9012503 | CIF | Ni P2 | P a -3 | 5.4706; 5.4706; 5.4706 90; 90; 90 | 163.721 | Donohue, P. C.; Bither, T. A.; Young, H. S. High-pressure synthesis of pyrite-type nickel diphosphide and nickel diarsenide Locality: synthetic Inorganic Chemistry, 1968, 7, 998-1001 |
| 9012504 | CIF | C3 H16 La2 O17 | P c c n | 8.984; 9.58; 17 90; 90; 90 | 1463.13 | Shinn, D. B.; Eick, H. A. The crystal structure of lanthanum carbonate octahydrate Inorganic Chemistry, 1968, 7, 1340-1345 |
| 9012505 | CIF | Ca2 Fe3 H6 O17 P3 | A 1 a 1 | 17.553; 19.354; 11.248 90; 95.84; 90 | 3801.35 | Moore, P. B.; Araki, T. Mitridatite, Ca6(H2O)6[FeIII9O6(PO4)9]*3H2O. A noteworthy octahedral sheet structure Inorganic Chemistry, 1977, 16, 1096-1106 |
| 9012506 | CIF | C14 Cl2 N2 Zn | C 1 2/c 1 | 9.115; 11.942; 14.428 90; 90.77; 90 | 1570.36 | Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336 |
| 9012507 | CIF | As Mg0.92 Mn4.08 O12 Sb Si | A 1 2/a 1 | 10.048; 19.418; 9.735 90; 95.83; 90 | 1889.59 | Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336 |
| 9012508 | CIF | C6 Cd N5 S2 | P -1 | 12.46; 9.07; 7.52 121.8; 123.4; 83.9 | 582.41 | Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336 |
| 9012509 | CIF | C3 H6 Ca O6 | C 1 2/m 1 | 13.955; 6.855; 6.835 90; 106.28; 90 | 627.629 | Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336 |
| 9012510 | CIF | H Mo Na O5 Zn | P n a m | 7.85; 9.292; 6.148 90; 90; 90 | 448.449 | Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336 |
| 9012511 | CIF | C4 H4 Cu Na2 O10 | P -1 | 7.536; 9.473; 3.576 81.9; 103.77; 108.09 | 235.071 | Gleizes, A.; Maury, F.; Galy, J. Crystal structure and magnetism of solum bis(oxalato)cuprate(II) dihydrate, Na2Cu(C2O4)2*2H2O. A deductive proposal for the structure of copper oxalate, CuC2O4*xH2O (0 < x < 1) Inorganic Chemistry, 1980, 19, 2074-2078 |
| 9012512 | CIF | Fe O4 P | P 31 2 1 | 5.036; 5.036; 11.255 90; 90; 120 | 247.199 | Long, G. J.; Cheetham, A. K.; Battle, P. D. Study of the iron-phosphorus-oxygen system by Mossbauer effect, neutron diffraction, magnetic susceptibility, and analytical electron microscopy: some pitfalls and solutions in the analysis of a complex mixture Inorganic Chemistry, 1983, 22, 3012-3016 |
| 9012513 | CIF | Fe5 H6 O20 P4 | C 1 2/c 1 | 17.492; 9.038; 9.349 90; 96.23; 90 | 1469.28 | Corbin, D. R.; Whitney, J. F.; Fultz, W. C.; Stucky, G. D.; Eddy, M. M.; Cheetham, A. K. Synthesis of open-framework transition-metal phosphates using organometallic precursors in acidic media. Preparation and structural characterization of Fe5P4O20H10 and NaFe3P3O12 Note: structure from ICSD Inorganic Chemistry, 1986, 25, 2279-2280 |
| 9012514 | CIF | Fe3 Na O12 P3 | C 1 2/c 1 | 11.998; 12.328; 6.5 90; 114.185; 90 | 877.037 | Corbin, D. R.; Whitney, J. F.; Fultz, W. C.; Stucky, G. D.; Eddy, M. M.; Cheetham, A. K. Synthesis of open-framework transition-metal phosphates using organometallic precursors in acidic media. Preparation and structural characterization of Fe5P4O20H10 and NaFe3P3O12 Note: structure from ICSD Inorganic Chemistry, 1986, 25, 2279-2280 |
| 9012515 | CIF | H2 Mn O5 P | C 1 2/c 1 | 6.912; 7.47; 7.357 90; 112.3; 90 | 351.451 | Lightfoot, P.; Cheetham, A. K.; Sleight, A. W. Structure of MnPO4*H2O by synchrotron X-ray powder diffraction Inorganic Chemistry, 1987, 26, 3544-3547 |
| 9012516 | CIF | O2 Sb | P n a 21 | 5.434; 4.8091; 11.779 90; 90; 90 | 307.816 | Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C Diantimony tetraoxides revisited Note: displacement parameters from ICSD Inorganic Chemistry, 1988, 27, 1367-1370 |
| 9012517 | CIF | O2 Sb | C 1 2/c 1 | 12.057; 4.8352; 5.384 90; 104.56; 90 | 303.796 | Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C Diantimony tetraoxides revisited Note: displacement parameters from ICSD Inorganic Chemistry, 1988, 27, 1367-1370 |
| 9012518 | CIF | Co O14 P2 V2 | I 4/m m m | 6.264; 6.264; 13.428 90; 90; 90 | 526.884 | Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748 |
| 9012519 | CIF | Ca H8 O14 P2 V2 | P 1 | 6.3484; 6.35; 6.597 106.81; 94.09; 90.02 | 253.867 | Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748 |
| 9012520 | CIF | H8 O14 P2 Sr V2 | C 1 c 1 | 9.026; 9.01; 12.841 90; 100.19; 90 | 1027.81 | Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748 |
| 9012521 | CIF | H6 O14 P2 Pb V2 | C 1 c 1 | 9.03; 9.021; 12.874 90; 100.16; 90 | 1032.27 | Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748 |
| 9012522 | CIF | As Be2 H9 O9 | P 1 21/a 1 | 7.2349; 12.686; 8.6548 90; 98.439; 90 | 785.754 | Harrison, W. T. A.; Nenoff, T. M.; Gier, T. E.; Stucky, G. D. Tetrahedral-atom 3-ring groupings in 1-dimensional inorganic chains: Be2AsO4OH*4H2O and Na2ZnPO4OH*7H2O Inorganic Chemistry, 1993, 32, 2437-2441 |
| 9012523 | CIF | H15 Na2 O12 P Zn | P 1 21/a 1 | 6.4212; 21.612; 8.6813 90; 109.899; 90 | 1132.82 | Harrison, W. T. A.; Nenoff, T. M.; Gier, T. E.; Stucky, G. D. Tetrahedral-atom 3-ring groupings in 1-dimensional inorganic chains: Be2AsO4OH*4H2O and Na2ZnPO4OH*7H2O Inorganic Chemistry, 1993, 32, 2437-2441 |
| 9012524 | CIF | D6 Mn N O5 P | P m n 21 | 5.7173; 8.8312; 4.8774 90; 90; 90 | 246.263 | Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 1.6 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927 |
| 9012525 | CIF | D6 Mn N O5 P | P m n 21 | 5.7142; 8.8255; 4.8762 90; 90; 90 | 245.91 | Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 21.4 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927 |
| 9012526 | CIF | D6 Mn N O5 P | P m n 21 | 5.7302; 8.8191; 4.9087 90; 90; 90 | 248.062 | Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 295 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927 |
| 9012527 | CIF | Ba H8 O14 P2 V2 | P 1 n 1 | 6.386; 12.7796; 6.387 90; 90.172; 90 | 521.244 | Roca, M.; Marcos, M. D.; Amoros, P.; Alamo, J.; Beltran-Porter A; Beltran-Porter D Synthesis and crystal structure of a novel lamellar barium derivative: Ba(VOPO4)2*4H2O. Synthetic pathways for layered oxovanadium phosphate hydrates M(VOPO4)2*nH2O Inorganic Chemistry, 1997, 36, 3414-3421 |
| 9012528 | CIF | H2 In O5 P | P -1 | 5.4342; 5.5508; 6.5446 97.593; 94.558; 107.565 | 185.064 | Tang, X. J.; Lachgar, A. The missing link: synthesis, crystal structure, and thermogravimetric studies of InPO4*H2O Inorganic Chemistry, 1998, 37, 6181-6185 |
| 9012529 | CIF | Ca2 H4 In O13 P3 | C 1 2/c 1 | 7.573; 15.838; 9.3126 90; 113.55; 90 | 1023.93 | X. Tang; A. Jones; A. Lachgar; B. J. Gross; J. L. Yarger Synthesis, crystal structure, NMR studies, and thermal stability of mixed iron-indium phosphates with quasi-one-dimensional frameworks Inorganic Chemistry, 1999, 38, 6032-6038 |
| 9012530 | CIF | Hg O | P n m a | 6.6129; 5.5208; 3.5219 90; 90; 90 | 128.579 | Aurivillius, K. Least-squares refinement of the crystal structures of orthorhombic HgO and of Hg2O2NaI Locality: synthetic Acta Chemica Scandinavica, 1964, 18, 1305-1306 |
| 9012531 | CIF | Hg2 I Na O2 | P 62 2 2 | 6.667; 6.667; 10.054 90; 90; 120 | 387.017 | Aurivillius, K. Least-squares refinement of the crystal structures of orthorhombic HgO and of Hg2O2NaI Locality: synthetic Acta Chemica Scandinavica, 1964, 18, 1305-1306 |
| 9012532 | CIF | N2 O Si2 | C m c 21 | 8.843; 5.473; 4.835 90; 90; 90 | 234.003 | Idrestedt, I.; Brosset, C. Structure of Si2N2O Acta Chemica Scandinavica, 1964, 18, 1879-1886 |
| 9012533 | CIF | C4.98 Cr K3 N6 O1.02 | P n c 2 | 13.38; 10.37; 8.38 90; 90; 90 | 1162.73 | Vannerberg, N. G. The crystal structure of K3Cr(CN)5NO Acta Chemica Scandinavica, 1966, 20, 1571-1576 |
| 9012534 | CIF | Mg3 O8 P2 | P 1 21/n 1 | 7.5957; 8.2305; 5.0775 90; 94.05; 90 | 316.634 | Nord, A. G.; Kierkegaard, P. The crystal structure of Mg3(PO4)2 Acta Chemica Scandinavica, 1968, 22, 1466-1474 |
| 9012535 | CIF | Cu7 Hg6 | R 3 m :R | 9.4024; 9.4024; 9.4024 90.425; 90.425; 90.425 | 831.151 | Lindahl, T.; Westman, S. The structure of the rhombohedral gamma brass like phase in the copper-mercury system Locality: synthetic Acta Chemica Scandinavica, 1969, 23, 1181-1190 |
| 9012536 | CIF | Co Se2 | P a -3 | 5.8593; 5.8593; 5.8593 90; 90; 90 | 201.158 | Furuseth, S.; Kjekshus, A.; Andresen, A. F. On the magnetic properties of CoSe2, NiS2, and NiSe2 Acta Chemica Scandinavica, 1969, 23, 2325-2334 |
| 9012537 | CIF | Ni Se2 | P a -3 | 5.9629; 5.9629; 5.9629 90; 90; 90 | 212.018 | Furuseth, S.; Kjekshus, A.; Andresen, A. F. On the magnetic properties of CoSe2, NiS2, and NiSe2 Acta Chemica Scandinavica, 1969, 23, 2325-2334 |
| 9012538 | CIF | Ni S2 | P a -3 | 5.6873; 5.6873; 5.6873 90; 90; 90 | 183.958 | Furuseth, S.; Kjekshus, A.; Andresen, A. F. On the magnetic properties of CoSe2, NiS2, and NiSe2 Acta Chemica Scandinavica, 1969, 23, 2325-2334 |
| 9012539 | CIF | Fe Sb2 | P n n m | 5.8328; 6.5376; 3.1973 90; 90; 90 | 121.921 | Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray diffractometer with strip charts Acta Chemica Scandinavica, 1969, 23, 3043-3050 |
| 9012540 | CIF | Fe Sb2 | P n n 2 | 5.8328; 6.5376; 3.1973 90; 90; 90 | 121.921 | Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray diffractometer with strip charts Acta Chemica Scandinavica, 1969, 23, 3043-3050 |
| 9012541 | CIF | Fe Sb2 | P n n m | 5.8328; 6.5376; 3.1973 90; 90; 90 | 121.921 | Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray counted by step-scanning Acta Chemica Scandinavica, 1969, 23, 3043-3050 |
| 9012542 | CIF | Fe Sb2 | P n n 2 | 5.8328; 6.5376; 3.1973 90; 90; 90 | 121.921 | Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray counted by step-scanning Acta Chemica Scandinavica, 1969, 23, 3043-3050 |
| 9012543 | CIF | Fe Sb2 | P n n m | 5.8328; 6.5376; 3.1973 90; 90; 90 | 121.921 | Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder neutron counted by step-scanning Acta Chemica Scandinavica, 1969, 23, 3043-3050 |
| 9012544 | CIF | Fe Sb2 | P n n m | 5.8328; 6.5376; 3.1973 90; 90; 90 | 121.921 | Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Single crystal X-ray from integrated Weissenberg film Acta Chemica Scandinavica, 1969, 23, 3043-3050 |
| 9012545 | CIF | Fe Sb2 | P n n 2 | 5.8328; 6.5376; 3.1973 90; 90; 90 | 121.921 | Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Single crystal X-ray from integrated Weissenberg film Acta Chemica Scandinavica, 1969, 23, 3043-3050 |
| 9012546 | CIF | Bi2 O3 | P 1 21/c 1 | 5.8486; 8.1661; 7.5097 90; 113; 90 | 330.153 | Malmros, G. The crystal structure of alpha-Bi2O3 Acta Chemica Scandinavica, 1970, 24, 384-396 |
| 9012547 | CIF | H3 Na O5 S | C 1 c 1 | 7.799; 7.79; 8.23 90; 119.95; 90 | 433.237 | Grimvall, S. The crystal structure of NaHSO4H2O Acta Chemica Scandinavica, 1971, 25, 3213-3219 |
| 9012548 | CIF | C H Nd O4 | P -6 | 12.32; 12.32; 9.88 90; 90; 120 | 1298.7 | Christensen, N. Hydrothermal preparation of rare earth hydroxycarbonates. The crystal structure of NdOHCO3 Acta Chemica Scandinavica, 1973, 27, 2973-2982 |
| 9012550 | CIF | As2 Fe | P n n m | 5.3012; 5.9858; 2.8822 90; 90; 90 | 91.458 | Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000 |
| 9012551 | CIF | Fe Se2 | P n n m | 4.8002; 5.7823; 3.5834 90; 90; 90 | 99.462 | Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000 |
| 9012552 | CIF | As2 Ni | P n n m | 4.7582; 5.7949; 3.544 90; 90; 90 | 97.72 | Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000 |
| 9012553 | CIF | Ni Sb2 | P n n m | 5.1823; 6.3168; 3.8403 90; 90; 90 | 125.714 | Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000 |
| 9012554 | CIF | Cu Se2 | P n n m | 5.0226; 6.1957; 3.7468 90; 90; 90 | 116.595 | Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000 |
| 9012563 | CIF | H3.78 Na O4.89 V | P 1 21/a 1 | 16.756; 3.6391; 8.023 90; 111.18; 90 | 456.17 | Bjornberg, A.; Hedman, B. The crystal structure of NaVO3*1.89H2O Note: one of the H atoms could not be found Acta Chemica Scandinavica A, 1977, 31, 579-584 |
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