Crystallography Open Database
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COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
9009216 | CIF | B15 H20 N3 O32 | C 1 2/c 1 | 25.27; 9.65; 11.56 90; 94.28; 90 | 2811.11 | Merlino S; Sartori F Ammonioborite: New borate polyion and its structure Science, 1971, 171, 377-379 |
9011555 | CIF | B15 H1.6 N3 O32 | C 1 2/c 1 | 25.27; 9.65; 11.56 90; 94.28; 90 | 2811.11 | Merlino, S.; Sartori, F. Ammonioborite: New borate polyion and its structure Science, 1971, 171, 377-379 |
1541879 | CIF | Ge2.052 In1.948 S8 | C 1 c 1 | 16.354; 16.035; 12.835 90; 129.551; 90 | 2595.23 | Zheng Nanfeng; Feng Pingyun; Bu Xianhui; Wang Bing Microporous and photoluminescent chalcogenide zeolite analogs Science, 2002, 298, 2366-2369 |
1535012 | CIF | C70 | C c m m | 17.303; 9.99; 17.924 90; 90; 90 | 3098.29 | Soldatov, A.V.; Dzyabchenko, A.; Roth, G.; Haluska, M.; Johnels, D.; Lebedkin, S.; Meingast, C.; Sundqvist, B.; Kuzmany, H. Topochemical polymerization of C70 controlled by monomer crystal packing Science, 2001, 293, 680-683 |
9011554 | CIF | Fe2 Na O15 Si6 | C m c e | 14.31; 17.28; 10.11 90; 90; 90 | 2499.97 | Merlino, S. Tuhualite crystal structure Locality: Mayor Island, New Zealand Note: Position of H2O not determined in paper Science, 1969, 166, 1399-1401 |
1538318 | CIF | Al7 H Mg3 O22 Si4 | C m c m | 16.1; 13.767; 6.735 90; 90; 90 | 1492.8 | Moore, P.B.; Bennett, J.M. Kornerupine: Its Crystal Structure Science, 1968, 159, 524-526 |
9009217 | CIF | Mg O3 Si | C m c m | 2.456; 8.042; 6.093 90; 90; 90 | 120.344 | Murakami, M.; Hirose, K.; Kawamura, K.; Sata, N.; Ohishi, Y. Post-perovskite phase transition in MgSiO3 Sample: P = 121 GPa, T = 300 K Note: CaIrO3-type structure from ab initio calculations using observed cell parameters Science, 2004, 304, 855-858 |
1538749 | CIF | Hg Te | F -4 3 m | 6.44; 6.44; 6.44 90; 90; 90 | 267.09 | Mariano, A.N.; Warekois, E.P. High pressure phases of some compounds of groups II-VI Science, 1963, 142, 672-673 |
1534581 | CIF | H45 K7 Na9 O91.5 P2 Pt W18 | F d d d :2 | 28.596; 31.788; 38.347 90; 90; 90 | 34857.8 | Anderson, T.M.; Neiwert, W.A.; Kirk, M.L.; Rui Cao,; Piccoli, P.M.B.; Schultz, A.J.; Koetzle, F.; Hill, C.L.; Keiji Morokuma,; Musaev, D.G. A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O)L2], L = [P W9 O34]9- Science, 2004, 306, 2074-2077 |
1534583 | CIF | H49.2 K7.6 Na1.4 O90.5 P2 Pd0.3 W18.7 | F d d d :2 | 28.637; 31.735; 38.228 90; 90; 90 | 34741.4 | Anderson, T.M.; Musaev, D.G.; Kirk, M.L.; Neiwert, W.A.; Schultz, A.J.; Piccoli, P.M.B.; Koetzle, F. A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O)L2], L = [P W9 O34]9- Science, 2004, 306, 2074-2077 |
1534585 | CIF | H45 K7 Na9 O91.5 P2 Pt0.5 W18 | F d d d :2 | 28.494; 31.687; 37.988 90; 90; 90 | 34299 | Anderson, T.M.; Neiwert, W.A.; Kirk, M.L.; Koetzle, F.; Piccoli, P.M.B.; Schultz, A.J.; Musaev, D.G. A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O) L2], L = [P W9 O34]9- Science, 2004, 306, 2074-2077 |
1522694 | CIF | La | F m -3 m | 5.17; 5.17; 5.17 90; 90; 90 | 138.188 | Piermarini, G.J.; Weir, C.E. Allotropy of some rare-earth metals at high pressure Science, 1964, 144, 69-71 |
1534836 | CIF | O Zn | F m -3 m | 4.28; 4.28; 4.28 90; 90; 90 | 78.403 | Bates, C.H.; White, W.B. New high-pressure polymorph of zinc oxide Science, 1962, 137, 993-993 |
1538565 | CIF | In P | F m -3 m | 5.71; 5.71; 5.71 90; 90; 90 | 186.169 | Jamieson, J.C. Crystal structures at high pressures of metallic modifications of compounds of indium, gallium, and aluminum Science, 1963, 139, 845-847 |
1539014 | CIF | Pr | F m -3 m | 4.88; 4.88; 4.88 90; 90; 90 | 116.214 | Piermarini, G.J.; Weir, C.E. Allotropy in some rare-earth metals at high pressures Science, 1964, 144, 69-71 |
1539306 | CIF | In Te | F m -3 m | 6.16; 6.16; 6.16 90; 90; 90 | 233.745 | Sclar, C.B.; Schwartz, C.M.; Carrison, L.C. Indium telluride (II'): Transitory intermediate phase in the transformation InTe(II) to InTe(I) Science, 1965, 147, 1569-1571 |
9011550 | CIF | Cs | F m -3 m | 5.984; 5.984; 5.984 90; 90; 90 | 214.277 | Hall, H. T.; Merrill, L.; Barnett, J. D. High-pressure polymorphism in cesium Sample: at P = 4.1 GPa & T = 27 C Note: known as Cesium-II Note: stable between 2.37 GPa & 4.22 GPa Science, 1964, 146, 1297-1299 |
9011551 | CIF | Cs | F m -3 m | 5.8; 5.8; 5.8 90; 90; 90 | 195.112 | Hall, H. T.; Merrill, L.; Barnett, J. D. High-pressure polymorphism in cesium Sample: at P = 4.25 GPa & T = 27 C Note: known as Cesium-III Note: stable between 4.22 GPa & 4.27 GPa Science, 1964, 146, 1297-1299 |
9011561 | CIF | Li | F m -3 m | 3.9; 3.9; 3.9 90; 90; 90 | 59.319 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 8.0 GPa, T = 296 K Note: film # 4-7 Science, 1983, 219, 1071-1072 |
9011562 | CIF | Li | F m -3 m | 3.855; 3.855; 3.855 90; 90; 90 | 57.289 | Olinger, B.; Shaner, J. W. Lithium, compression and high-pressure structure Sample: at P = 9.6 GPa, T = 296 K Note: film # 2-8 Science, 1983, 219, 1071-1072 |
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