Crystallography Open Database
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Searching year of publication is 2017
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
7228524 | CIF | Se | P 31 2 1 | 4.3125; 4.3125; 4.9711 90; 90; 120 | 80.065 | Boeré, René; Hill, Nathan D. D. High Z’ structures of 1,2,3,5-dithiadiazolyls and of 1,2,3,5-diselenadiazolyls containing the first structurally characterized monomeric diselenadiazolyls CrystEngComm, 2017 |
4345680 | CIF | Ga Re Si | P 4/n m m | 3.1942; 3.1942; 8.054 90; 90; 90 | 82.17 | Xie, Weiwei; Gustin, Lea; Bian, Guang 111-Type Semiconductor ReGaSi Follows 14e(-) Rules. Inorganic chemistry, 2017 |
4126741 | CIF | Fe2 O4.846 Yb | P -1 | 3.4659; 3.4659; 8.3694 90; 90; 120 | 87.068 | Nicoud, Sarah; Huvé, Marielle; Hernandez, Olivier; Pautrat, Alain; Duttine, Mathieu; Wattiaux, Alain; Colin, Claire; Kabbour, Houria; Mentré, Olivier Comprehensive Study of Oxygen Storage in YbFe2O4+x (x ≤ 0.5): Unprecedented Coexistence of FeOn Polyhedra in One Single Phase. Journal of the American Chemical Society, 2017 |
4002732 | CIF | Ca N2 Ti | P m m n :2 | 3.9365; 3.6131; 7.5421 90; 90; 90 | 107.27 | Li, Xiaohui; Wang, Xiaoming; Han, Yifeng; Jing, Xiping; Huang, Qingzhen; Kuang, Xiaojun; Gao, Qilong; Chen, Jun; Xing, Xianran High-Dielectric-Permittivity Layered Nitride CaTiN2 Chemistry of Materials, 2017 |
4002733 | CIF | Ca N2 Ti | P 21 m n | 3.9365; 3.6137; 7.543 90; 90; 90 | 107.3 | Li, Xiaohui; Wang, Xiaoming; Han, Yifeng; Jing, Xiping; Huang, Qingzhen; Kuang, Xiaojun; Gao, Qilong; Chen, Jun; Xing, Xianran High-Dielectric-Permittivity Layered Nitride CaTiN2 Chemistry of Materials, 2017 |
7120700 | CIF | Bi Ni | C m c m | 3.3873; 9.4079; 3.7587 90; 90; 90 | 119.78 | Powderly, Kelly M.; Clarke, Samantha M.; Amsler, Maximilian; Wolverton, Chris M.; Malliakas, Christos D.; Meng, Yue; Jacobsen, Steven D.; Freedman, Danna High-pressure discovery of β-NiBi Chem. Commun., 2017 |
8106647 | CIF | C4 H5 N3 O2 | P 1 | 3.8976; 5.7235; 6.267 89.63; 84.8; 76.97 | 135.63 | Jianlong, Wang; Pengbao, Lian; Lizhen, Chen Crystal structure of the triclinic modification of 1-methyl-4-nitroimidzole, C4H5N3O2 Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 699-700 |
1547850 | CIF | Ag0.41 Nb0.59 O1.68 | F m -3 m | 5.286; 5.286; 5.286 90; 90; 90 | 147.7 | Withanage, I.; Kumada, N.; Takei, T.; Yanagida, S.; Kuroiwa, Y.; Moriyoshi, C. Synthesis and crystal structure of pyrochlore-type silver niobate and tantalate Journal of the Ceramic Society of Japan, 2017, 125, 776-778 |
1546929 | CIF | C2 D5 N O2 | P 1 n 1 | 5.023; 5.9846; 5.4946 90; 114.654; 90 | 150.11 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
1546928 | CIF | C2 D5 N O2 | I 1 | 5.1; 6.285; 5.4295 85.815; 114.456; 104.136 | 153.545 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
1546931 | CIF | C2 D5 N O2 | I 1 | 5.1029; 6.345; 5.4331 85.91; 114.26; 103.55 | 155.85 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
2242273 | CIF Paper | Ce H2 O6 P2 | P -3 m 1 | 5.6859; 5.6859; 5.6099 90; 90; 120 | 157.067 | Byer, Stefano H.; Villa, Eric M. Synthesis and crystal structure of cerium(IV) bis(phosphite) Acta Crystallographica Section E, 2017, 73, 1290-1293 |
1546930 | CIF | C2 D5 N O2 | P 1 21 1 | 5.0907; 6.25954; 5.3871 90; 113.261; 90 | 157.709 | Bull, Craig L.; Flowitt-Hill, Giles; de Gironcoli, Stefano; Küçükbenli, Emine; Parsons, Simon; Pham, Cong Huy; Playford, Helen Y.; Tucker, Matthew G. ζ-Glycine: insight into the mechanism of a polymorphic phase transition IUCrJ, 2017, 4, 569-574 |
7227257 | CIF | Al Ca Gd O4 | I 4/m m m | 3.6632; 3.6632; 11.998 90; 90; 90 | 161 | Hu, Qiangqiang; Jia, Zhitai; Tang, Cheng; Lin, Na; Zhang, Jian; Jia, Ning; Wang, Shanpeng; Zhao, Xian; Tao, Xutang The origin of coloration of CaGdAlO4 crystals and its effect on their physical properties CrystEngComm, 2017, 19, 537 |
2108042 | CIF HKL | Al4.847 O9.577 Si1.153 | P b a m | 7.5817; 7.6752; 2.8843 90; 90; 90 | 167.84 | Klar, Paul B.; de la Pinta, Noelia; Lopez, Gabriel A.; Etxebarria, Iñigo; Breczewski, Tomasz; Madariaga, Gotzon Ordered vacancy distribution in 2/1 mullite: a superspace model Acta Crystallographica Section B, 2017, 73 |
4002817 | CIF | Bi Cu | P m m a | 5.188995; 4.230802; 7.86657 90; 90; 90 | 172.7 | Clarke, Samantha M.; Amsler, Maximilian; Walsh, James P. S.; Yu, Tony; Wang, Yanbin; Meng, Yue; Jacobsen, Steven D.; Wolverton, Chris; Freedman, Danna E. Creating Binary Cu‒Bi Compounds via High-Pressure Synthesis: A Combined Experimental and Theoretical Study Chemistry of Materials, 2017, 29, 5276 |
4002757 | CIF | B2 Mg1.33 Mn0.66 O5 | P -1 | 3.18809; 6.2021; 9.36747 104.556; 90.5538; 92.0289 | 179.131 | Glass, Hugh F. J.; Liu, Zigeng; Bayley, Paul M.; Suard, Emmanuelle; Bo, Shou-Hang; Khalifah, Peter G.; Grey, Clare P.; Dutton, Siân E. MgxMn2‒xB2O5 Pyroborates (2/3 ≤ x ≤ 4/3): High Capacity and High Rate Cathodes for Li-Ion Batteries Chemistry of Materials, 2017, 29, 3118 |
4002758 | CIF | B2 Mg Mn O5 | P -1 | 3.20758; 6.2134; 9.4127 104.623; 90.511; 92.012 | 181.376 | Glass, Hugh F. J.; Liu, Zigeng; Bayley, Paul M.; Suard, Emmanuelle; Bo, Shou-Hang; Khalifah, Peter G.; Grey, Clare P.; Dutton, Siân E. MgxMn2‒xB2O5 Pyroborates (2/3 ≤ x ≤ 4/3): High Capacity and High Rate Cathodes for Li-Ion Batteries Chemistry of Materials, 2017, 29, 3118 |
1548796 | CIF HKL Paper | O2 Te | P 21 21 21 | 4.8809; 8.5668; 4.3433 90; 90; 90 | 181.609 | Weil, Matthias Redetermination of the γ-form of tellurium dioxide IUCrData, 2017, 2 |
4002700 | CIF | Gd H2 N O5 | P 1 21 1 | 6.355; 3.723; 7.749 90; 96.919; 90 | 182 | Song, Yunxia; Luo, Min; Lin, Chensheng; Ye, Ning Structural Modulation of Nitrate Group with Cations to Affect SHG Responses in RE(OH)2NO3 (RE = La, Y, and Gd): New Polar Materials with Large NLO Effect after Adjusting pH Values of Reaction Systems Chemistry of Materials, 2017 |
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