Crystallography Open Database
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Searching space group like 'P 63 m c'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
2238069 | CIF HKL Paper | As4 H4.5 Mg6.75 O19 | P 63 m c | 12.7651; 12.7651; 5.0844 90; 90; 120 | 717.49 | Weil, Matthias Mg~6.75~(OH)~3~(H~0.166~AsO~4~)~3~(HAsO~4~), a member of the <i>M</i>~1-~<i>~x~M</i>'~6~(OH)~3~(H~2<i>x~/3</i>AsO~4~)~3~(HAsO~4~) family (<i>M</i>,<i>M</i>' = Co; Ni) Acta Crystallographica Section E, 2013, 69, i29 |
2241733 | CIF HKL Paper | Ge Li2 Mo3 O8 | P 63 m c | 5.7268; 5.7268; 9.9841 90; 90; 120 | 283.57 | Gall, Philippe; Gougeon, Patrick Li~2~GeMo~3~O~8~: a novel reduced molybdenum oxide containing Mo~3~O~13~ cluster units Acta Crystallographica Section E, 2016, 72, 995-997 |
2243616 | CIF HKL Paper | Al0.4 Ba1.8 Ce0.2 Lu2 N13.8 O0.2 Si7.6 | P 63 m c | 6.0378; 6.0378; 9.8133 90; 90; 120 | 309.82 | Simura, Rayko; Yamane, Hisanori Lu-atom-ordered oxonitridoaluminosilicate Ba~0.9~Ce~0.1~LuAl~0.2~Si~3.8~N~6.9~O~0.1~ Acta Crystallographica Section E, 2020, 76, 1708-1711 |
2300112 | CIF Paper | O Zn | P 63 m c | 3.2494; 3.2494; 5.2054 90; 90; 120 | 47.598 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
2300113 | CIF Paper | O Zn | P 63 m c | 3.2342; 3.2342; 5.1772 90; 90; 120 | 46.899 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
2300114 | CIF Paper | O Zn | P 63 m c | 3.219; 3.219; 5.1489 90; 90; 120 | 46.205 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
2300115 | CIF Paper | O Zn | P 63 m c | 3.2049; 3.2049; 5.1216 90; 90; 120 | 45.558 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
2300116 | CIF Paper | O Zn | P 63 m c | 3.195; 3.195; 5.1027 90; 90; 120 | 45.11 | Sowa, Heidrun; Ahsbahs, Hans High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape Journal of Applied Crystallography, 2006, 39, 169-175 |
2300450 | CIF HKL Paper | O Zn | P 63 m c | 3.249308; 3.249308; 5.205709 90; 90; 120 | 47.5984 | Schreyer, Martin; Guo, Liangfeng; Thirunahari, Satyanarayana; Gao, Feng; Garland, Marc Simultaneous determination of several crystal structures from powder mixtures: the combination of powder X-ray diffraction, band-target entropy minimization and Rietveld methods Journal of Applied Crystallography, 2014, 47, 659-667 |
2310195 | CIF | Ni3 Th7 | P 63 m c | 9.86; 9.86; 6.23 90; 90; 120 | 524.533 | Florio, J.V.; Baenziger, N.C.; Rundle, R.E. Compounds of thorium with transition metals. 2. Systems with iron, cobalt and nickel Acta Crystallographica (1,1948-23,1967), 1956, 9, 367-372 |
2310262 | CIF | Lu Mn5 | P 63 m c | 5.186; 5.186; 8.566 90; 90; 120 | 199.514 | Wang, F.E.; Gilfrich, J.V. The crystal structures of Lu Mn5 and the R Mn12 compounds (where R= Gd, Tb, Dy, Ho, Er and Tm) Acta Crystallographica (1,1948-23,1967), 1966, 21, 476-481 |
2310263 | CIF | Gd13 Zn58 | P 63 m c | 14.352; 14.352; 14.218 90; 90; 120 | 2536.26 | Wang, F.E. The crystal structure of Gd13 Zn58 Acta Crystallographica (1,1948-23,1967), 1967, 22, 579-584 |
2310302 | CIF | Ce24 Co11 | P 63 m c | 9.587; 9.587; 21.825 90; 90; 120 | 1737.2 | Larson, A.C.; Cromer, D.T. The crystal structure of Ce24 Co11 Acta Crystallographica (1,1948-23,1967), 1962, 15, 1224-1227 |
2310310 | CIF | Ce7 Ni3 | P 63 m c | 9.92; 9.92; 6.33 90; 90; 120 | 539.458 | Roof, R.B.jr.; Larson, A.C.; Cromer, D.T. The crystal structure of Ce7 Ni3 Acta Crystallographica (1,1948-23,1967), 1961, 14, 1084-1087 |
2310332 | CIF | Mo3 O8 Zn2 | P 63 m c | 5.759; 5.759; 9.903 90; 90; 120 | 284.441 | Ansell, G.B.; Katz, L. A refinement of the crystal structure of zinc molybdenum(IV) oxide, Zn2 Mo3 O8 Acta Crystallographica (1,1948-23,1967), 1966, 21, 482-485 |
2310415 | CIF | C3 Al5 N | P 63 m c | 3.281; 3.281; 21.67 90; 90; 120 | 202.024 | Jeffrey, G.A.; Wu, V.Y. The structures of the aluminum carbonitrides. II Acta Crystallographica (1,1948-23,1967), 1966, 20, 538-547 |
2310416 | CIF | C3 Al7 N3 | P 63 m c | 3.226; 3.226; 31.7 90; 90; 120 | 285.706 | Jeffrey, G.A.; Wu, V.Y. The structures of the aluminum carbonitrides. II Acta Crystallographica (1,1948-23,1967), 1966, 20, 538-547 |
2310546 | CIF | Ba S3 Ti | P 63 m c | 6.758; 6.758; 5.778 90; 90; 120 | 228.531 | Clearfield, A. The synthesis and crystal structures of some alkaline earth titanium and zirkonium sulfides Acta Crystallographica (1,1948-23,1967), 1963, 16, 135-142 |
2310592 | CIF | Fe2.5 O16 V7.11 | P 63 m c | 5.854; 5.854; 9.295 90; 90; 120 | 275.858 | Hanson, A.W. The crystal structure of nolanite Acta Crystallographica (1,1948-23,1967), 1958, 11, 703-709 |
2310812 | CIF | S Zn | P 63 m c | 3.82; 3.82; 50.07999 90; 90; 120 | 632.88 | Mardix, S.; Alexander, E.; Brafman, O.; Steinberger, I.T. Polytype families in zinc sulfide crystals Acta Crystallographica (1,1948-23,1967), 1967, 22, 808-812 |
2310902 | CIF | Rh3 Th7 | P 63 m c | 10.028; 10.028; 6.293 90; 90; 120 | 548.046 | Ferro, R.; Rambaldi, G. The phase D102 type in the thorium-rhodium alloy system Acta Crystallographica (1,1948-23,1967), 1961, 14, 1094-1094 |
2310932 | CIF | C Si | P 63 m c | 3.079; 3.079; 20.146 90; 90; 120 | 165.401 | Ramsdell, L.S.; Kohn, J.A. Developments in silicon carbide research Acta Crystallographica (1,1948-23,1967), 1952, 5, 215-224 |
2311946 | CIF Paper | Ag K7 O16 W4 | P 63 m c | 12.4912; 12.4912; 7.4526 90; 90; 120 | 1007.04 | Spiridonova, Tatyana S.; Solodovnikov, Sergey F.; Savina, Aleksandra A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu; Lazoryak, Bogdan I.; Korolkov, Iliya V.; Khaikina, Elena G. Synthesis, crystal structures and properties of the new compounds K<sub>7-x</sub>Ag<sub>1+x</sub>(XO<sub>4</sub>)<sub>4</sub> (X = Mo, W). Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1071-1077 |
2311947 | CIF Paper | Ag1.32 K6.68 Mo4 O16 | P 63 m c | 12.4188; 12.4188; 7.4338 90; 90; 120 | 992.89 | Spiridonova, Tatyana S.; Solodovnikov, Sergey F.; Savina, Aleksandra A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu; Lazoryak, Bogdan I.; Korolkov, Iliya V.; Khaikina, Elena G. Synthesis, crystal structures and properties of the new compounds K<sub>7-x</sub>Ag<sub>1+x</sub>(XO<sub>4</sub>)<sub>4</sub> (X = Mo, W). Acta crystallographica. Section C, Structural chemistry, 2017, 73, 1071-1077 |
2312498 | CIF | Ge4 N4 O4 Sn | P 63 m c | 5.876; 5.876; 9.418 90; 90; 120 | 281.6 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
2312499 | CIF | Ge4.158 N4 O4 Sn0.842 | P 63 m c | 5.839; 5.839; 9.365 90; 90; 120 | 276.51 | Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction. Acta crystallographica Section B, Structural science, crystal engineering and materials, 2024, 80 |
3000229 | On hold until 2020-03-19 | Al5 H O8 | P 63 m c | 5.6244; 5.6244; 8.8417 90; 90; 120 | 242.22 | Parise, John B.; Xia, Bingying; Simonson, Jack W.; Woerner, William R.; Plonka, Anna M.; Phillips, Brian L.; Ehm, Lars To be published in Crystals |
3000230 | On hold until 2020-03-19 | Al5 H O8 | P 63 m c | 5.576099; 5.5761; 8.77247 90; 90; 120 | 236.218 | Parise, John B.; Xia, Bingying; Simonson, Jack W.; Woerner, William R.; Plonka, Anna M.; Phillips, Brian L.; Ehm, Lars To be published in Crystals |
3500056 | CIF | H12 Ni12 O38 P8 | P 63 m c | 12.4544; 12.4544; 4.94856 90; 90; 120 | 664.75 | Armel Le Bail Ni12(HPO4)6(PO4)2(OH)6 P63mc related to COD 4313804 and to COD 1000115 and dumortierite Personal communication to COD, 2016 |
4000325 | CIF | Ga0.98 Mn0.02 N | P 63 m c | 3.2026; 3.2026; 5.1987 90; 90; 120 | 46.178 | Chemistry of Materials, 2003 |
4000326 | CIF | Ga0.95 Mn0.05 N | P 63 m c | 3.1968; 3.1968; 5.1901 90; 90; 120 | 45.934 | Chemistry of Materials, 2003 |
4000879 | CIF | H4 I Li3 N2 | P 63 m c | 7.09109; 7.09109; 11.50958 90; 90; 120 | 501.206 | Matsuo, Motoaki; Sato, Toyoto; Miura, Yohei; Oguchi, Hiroyuki; Zhou, Yu; Maekawa, Hideki; Takamura, Hitoshi; Orimo, Shin-ichi Synthesis and Lithium Fast-Ion Conductivity of a New Complex Hydride Li3(NH2)2I with Double-Layered Structure Chemistry of Materials, 2010, 22, 2702 |
4000911 | CIF | Cs2 H12 Mn2 O20 P2 | P 63 m c | 6.986813; 6.986813; 12.037947 90; 90; 120 | 508.91 | Ferdov, Stanislav; Lin, Zhi Selective Detection of Cs+in Water Solutions via One-Step Formation of a New Type of Struvite-Like Phosphate Chemistry of Materials, 2010, 22, 5345 |
4001316 | CIF | Ga0.96 Mn0.04 N | P 63 m c | 3.1932; 3.1932; 5.185 90; 90; 120 | 45.79 | Kaminski, Michal; Podsiadlo, Slawomir; Dominik, Pawel; Wozniak, Krzysztof; Dobrzycki, Lukasz; Jakiela, Rafal; Barcz, Adam; Psoda, Marek; Mizera, Jaroslaw; Bacewicz, Rajmund; Zajac, Marcin; Twardowski, Andrzej New Chemical Method of Obtaining Thick Ga1-xMnxN Layers: Prospective Spintronic Material Chemistry of Materials, 2007, 19, 3139 |
4001352 | CIF | C12 H40 Al0.57 Cr0.1 N2 O16 P4 Zn2 | P 63 m c | 15.269; 15.269; 10.336 90; 90; 120 | 2086.9 | Yang, Yali; Li, Niu; Song, Haibin; Wang, Honggen; Chen, Wenbin; Xiang, Shouhe Metal Phosphite Containing 24-Ring Channels with 10-Ring Windows Chemistry of Materials, 2007, 19, 1889 |
4001595 | CIF | Ba5 Mg0.125 O15 Ta3.95 | P 63 m c | 5.810528; 5.810528; 23.88459 90; 90; 120 | 698.36 | Mallinson, P.; Claridge, J. B.; Iddles, D.; Price, T.; Ibberson, R. M.; Allix, M.; Rosseinsky, M. J. New 10-Layer Hexagonal Perovskites: Relationship between Cation and Vacancy Ordering and Microwave Dielectric Loss Chemistry of Materials, 2006, 18, 6227 |
4002361 | CIF | Ba6 Fe4 La2 O15 | P 63 m c | 11.8816; 11.8816; 7.0714 90; 90; 120 | 864.542 | Abe, K.; Doi, Y.; Hinatsu, Y.; Ohoyama, K. Magnetic properties of the spin tetramer compound Ba6 La2 Fe4 O15 Chemistry of Materials (1,1989-), 2006, 18, 785-789 |
4002362 | CIF | Ba6 Ga4 La2 O15 | P 63 m c | 11.8426; 11.8426; 7.09 90; 90; 120 | 861.134 | Abe, K.; Doi, Y.; Hinatsu, Y.; Ohoyama, K. Magnetic properties of the spin tetramer compound Ba6 La2 Fe4 O15 Chemistry of Materials (1,1989-), 2006, 18, 785-789 |
4002702 | CIF | Cl Ge4 Na O16 Sr2 V3 | P 63 m c | 10.4084; 10.4084; 7.2791 90; 90; 120 | 682.93 | Sanjeewa, Liurukara D.; McGuire, Michael A.; McMillen, Colin D.; Garlea, Vasile O.; Kolis, Joseph W. Polar Materials with Isolated V4+ S = 1/2 Triangles: NaSr2V3O3(Ge4O13)Cl and KSr2V3O3(Ge4O13)Cl Chemistry of Materials, 2017, 29, 1404 |
4002703 | CIF | Cl Ge4 K O16 Sr2 V3 | P 63 m c | 10.4679; 10.4679; 7.2427 90; 90; 120 | 687.31 | Sanjeewa, Liurukara D.; McGuire, Michael A.; McMillen, Colin D.; Garlea, Vasile O.; Kolis, Joseph W. Polar Materials with Isolated V4+ S = 1/2 Triangles: NaSr2V3O3(Ge4O13)Cl and KSr2V3O3(Ge4O13)Cl Chemistry of Materials, 2017, 29, 1404 |
4002704 | CIF | Bi3 F3 I4 O13 | P 63 m c | 10.8797; 10.8797; 6.9926 90; 90; 120 | 716.81 | Zhang, Min; Su, Xin; Mutailipu, Miriding; Yang, Zhihua; Pan, Shilie Bi3OF3(IO3)4: Metal Oxyiodate Fluoride Featuring a Carbon-Nanotube-like Topological Structure with Large Second Harmonic Generation Response Chemistry of Materials, 2017, 29, 945 |
4003635 | CIF | F6 Ga3 O6 Rb Se2 | P 63 m c | 7.1711; 7.1711; 11.7115 90; 90; 120 | 521.57 | Wu, Chao; Jiang, Xingxing; Lin, Lin; Lin, Zheshuai; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi AGa3F6(SeO3)2 (A = Rb, Cs): A New Type of Phase-Matchable Hexagonal Tungsten Oxide Material with Strong Second-Harmonic Generation Responses Chemistry of Materials, 2020 |
4003636 | CIF | Cs F6 Ga3 O6 Se2 | P 63 m c | 7.1876; 7.1876; 11.8681 90; 90; 120 | 530.98 | Wu, Chao; Jiang, Xingxing; Lin, Lin; Lin, Zheshuai; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi AGa3F6(SeO3)2 (A = Rb, Cs): A New Type of Phase-Matchable Hexagonal Tungsten Oxide Material with Strong Second-Harmonic Generation Responses Chemistry of Materials, 2020 |
4003855 | CIF | As Na Sn | P 63 m c | 4.015; 4.015; 11.766 90; 90; 120 | 164.26 | Ochs, Andrew M.; Gorai, Prashun; Wang, Yaxian; Scudder, Michael R.; Koster, Karl; Moore, Curtis E.; Stevanovic, Vladan; Heremans, Joseph P.; Windl, Wolfgang; Toberer, Eric S.; Goldberger, Joshua E. Computationally Guided Discovery of Axis-Dependent Conduction Polarity in NaSnAs Crystals Chemistry of Materials, 2021 |
4004057 | CIF | Ag0.28 Mn0.86 Sb2 Yb2 | P 63 m c | 4.654; 4.654; 7.6686 90; 90; 120 | 143.85 | Liu, Kefeng; Liu, Jian; Liu, Qian; Wang, Qiqi; Yu, Fang; Liu, Xiao-Cun; Xia, Sheng-Qing Phase Transitions, Structure Evolution, and Thermoelectric Properties Based on A2MnSb2 (A = Ca, Yb) Chemistry of Materials, 2021, 33, 9732-9740 |
4004058 | CIF | Ag0.58 Ca2 Mn0.71 Sb2 | P 63 m c | 4.6848; 4.6848; 7.7443 90; 90; 120 | 147.2 | Liu, Kefeng; Liu, Jian; Liu, Qian; Wang, Qiqi; Yu, Fang; Liu, Xiao-Cun; Xia, Sheng-Qing Phase Transitions, Structure Evolution, and Thermoelectric Properties Based on A2MnSb2 (A = Ca, Yb) Chemistry of Materials, 2021, 33, 9732-9740 |
4030284 | CIF | Ce4 Cl2 O S4 | P 63 m c | 9.2549; 9.2549; 6.9413 90; 90; 120 | 514.89 | Schleid, T. Ce4OS4Cl2 : the first oxysulfide-chloride of the lanthanides European Journal of Solid State and Inorganic Chemistry, 1991, 28, 737-748 |
4030845 | CIF | Cl6 O Sr4 | P 63 m c | 9.4513; 9.4513; 7.2036 90; 90; 120 | 557.27 | Hagemann, H.; Kubel, F.; Bill, H. Crystal structure of Sr4OCl6 European Journal of Solid State and Inorganic Chemistry, 1996, 33, 1101-1109 |
4030894 | CIF | Li Mo2 O8 Tl3 | P 63 m c | 6.0037; 6.0037; 15.8194 90; 90; 120 | 493.809 | Colbeau-Justin, C.; Wallez, G.; Xuriguera, A.-M.; Elfakir, A.; Jaulmes, S.; Quarton, M. Structure determination of Tl3Li(MoO4)2. Stereochemical activity of Tl(I) lone pair European Journal of Solid State and Inorganic Chemistry, 1997, 34, 1097-1106 |
4107203 | CIF | C3 Ba4 Cs3 F5 O9 | P 63 m c | 11.5158; 11.5158; 7.6132 90; 90; 120 | 874.35 | Guohong Zou; Ning Ye; Ling Huang; Xinsong Lin Alkaline-Alkaline Earth Fluoride Carbonate Crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as Nonlinear Optical Materials Journal of the American Chemical Society, 2011, 133, 20001-20007 |
4114282 | CIF | Cl Fe N3 O3 | P 63 m c | 7.1701; 7.1701; 6.0403 90; 90; 120 | 268.93 | Trevor W. Hayton; W. Stephen McNeil; Brian O. Patrick; Peter Legzdins Toward Binary Nitrosyls: Distinctly Bent Fe-N-O Linkages in Base-Stabilized Fe(NO)3+ Complexes Journal of the American Chemical Society, 2003, 125, 12935-12944 |
4117966 | CIF | Mn O | P 63 m c | 3.3717; 3.3717; 5.3855 90; 90; 120 | 53.022 | Ki Min Nam; Yong-Il Kim; Younghun Jo; Seung Mi Lee; Bog G. Kim; Ran Choi; Sang-Il Choi; Hyunjoon Song; Joon T. Park New Crystal Structure: Synthesis and Characterization of Hexagonal Wurtzite MnO Journal of the American Chemical Society, 2012, 134, 8392-8395 |
4118879 | CIF | C7 H18 Br4 Fe N | P 63 m c | 8.169; 8.169; 13.411 90; 90; 120 | 775 | Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III) Journal of the American Chemical Society, 2012, 134, 18487-18490 |
4118880 | CIF | C7 H18 Br4 Fe N | P 63 m c | 8.267; 8.267; 13.524 90; 90; 120 | 800.4 | Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III) Journal of the American Chemical Society, 2012, 134, 18487-18490 |
4118881 | CIF | C7 H18 Br4 Fe N | P 63 m c | 8.265; 8.265; 13.539 90; 90; 120 | 800.9 | Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III) Journal of the American Chemical Society, 2012, 134, 18487-18490 |
4118882 | CIF | C7 H18 Br4 Fe N | P 63 m c | 8.344; 8.344; 13.67 90; 90; 120 | 824.2 | Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III) Journal of the American Chemical Society, 2012, 134, 18487-18490 |
4120249 | CIF | Ag0.92 Ca0.89 La0.11 Sb | P 63 m c | 4.7029; 4.7029; 7.7921 90; 90; 120 | 149.25 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
4120250 | CIF | Ag0.9 Ca0.84 Ce0.16 Sb | P 63 m c | 4.7023; 4.7023; 7.7951 90; 90; 120 | 149.27 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
4120251 | CIF | Ag0.86 Ca0.87 Pr0.14 Sb | P 63 m c | 4.7057; 4.7057; 7.788 90; 90; 120 | 149.35 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
4120252 | CIF | Ag0.87 Ca0.86 Nd0.14 Sb | P 63 m c | 4.6931; 4.6931; 7.753 90; 90; 120 | 147.88 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
4120253 | CIF | Ag0.88 Ca0.83 Sb Sm0.17 | P 63 m c | 4.7008; 4.7008; 7.759 90; 90; 120 | 148.48 | Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance Journal of the American Chemical Society, 2013, 135, 11840-11848 |
4124615 | CIF | Ga11.52 K8.88 O96 Si36.48 | P 63 m c | 21.03; 21.03; 8.53 90; 90; 120 | 3267.07 | Strohmaier, K.G.; Vaughan, D.E.W. Structure of the first silicate molecular sieve with 18-ring pore openings, ECR-34 Journal of the American Chemical Society, 2003, 125, 16035-16039 |
4131893 | CIF | C4 H11 Br3 Cd Cl N | P 63 m c | 9.514; 9.514; 7.0191 90; 90; 120 | 550.22 | Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response. Journal of the American Chemical Society, 2018, 140, 3975-3980 |
4131894 | CIF | C4 H11 Br3 Cd Cl N | P 63 m c | 9.402; 9.402; 6.977 90; 90; 120 | 534.1 | Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response. Journal of the American Chemical Society, 2018, 140, 3975-3980 |
4132587 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.8607; 14.8607; 6.7012 90; 90; 120 | 1281.63 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
4132588 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.9319; 14.9319; 6.7338 90; 90; 120 | 1300.23 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
4132589 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.7885; 14.7885; 6.6738 90; 90; 120 | 1264.01 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
4132590 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.6822; 14.6822; 6.6323 90; 90; 120 | 1238.16 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
4132591 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.8806; 14.8806; 6.7146 90; 90; 120 | 1287.63 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
4132592 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 14.747; 14.747; 6.6608 90; 90; 120 | 1254.48 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
4132593 | CIF | C9 H30 Br7 Mn2 N3 | P 63 m c | 15.0014; 15.0014; 6.7669 90; 90; 120 | 1318.82 | Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>). Journal of the American Chemical Society, 2018, 140, 8110-8113 |
4308619 | CIF | C12 H32 N18 O4 S12 Se4 W4 | P 63 m c | 17.34; 17.34; 10.541 90; 90; 120 | 2744.8 | M. Sokolov; P. Esparza; R. Hernandez-Molina; J. G. Platas; A. Mederos; J. A. Gavin; R. Llusar; C. Vicent Preparation and Properties of the Full Series of Cuboidal Clusters [MoxW4-xSe4(H2O)12]n+ (n= 4-6) and Their Derivatives Inorganic Chemistry, 2005, 44, 1132-1141 |
4309877 | CIF | C9 K5 N9 Se3 Te W3 | P 63 m c | 18.6413; 18.6413; 12.9868 90; 90; 120 | 3908.3 | Maxim N. Sokolov; Pavel A. Abramov; Artem L. Gushchin; Irina V. Kalinina; Dmitry Y. Naumov; Alexander V. Virovets; Eugenia V. Peresypkina; Cristian Vicent; Rosa Llusar; Vladimir P. Fedin Synthesis and Reactivity of W3Te74+ Clusters and Chalcogen Exchange in the M3Q7 (M = Mo, W; Q = S, Se, Te) Cluster Family Inorganic Chemistry, 2005, 44, 8116-8124 |
4312562 | CIF | C16 H34.5 Mo N3.5 S3 | P 63 m c | 13.549; 13.549; 7.227 90; 90; 120 | 1149 | David V. Partyka; Richard J. Staples; R. H. Holm Nucleophilic Reactivity and Oxo/Sulfido Substitution Reactions of MVIO3 Groups (M = Mo, W) Inorganic Chemistry, 2003, 42, 7877-7886 |
4312887 | CIF | Br3 Cd Cs | P 63 m c | 7.7281; 7.7281; 6.742 90; 90; 120 | 348.71 | Peng Ren; Jingui Qin; Chuangtian Chen A Novel Nonlinear Optical Crystal for the IR Region: Noncentrosymmetrically Crystalline CsCdBr3 and Its Properties Inorganic Chemistry, 2003, 42, 8-10 |
4313804 | CIF | As1.33 H1.68 Ni2.16 O6.33 | P 63 m c | 12.7021; 12.7021; 4.9966 90; 90; 120 | 698.2 | Robert W. Hughes; Lee A. Gerrard; Daniel J. Price; Mark T. Weller A Hybrid Metalloarsenate 3D Framework-1D Interrupted Metal Oxide Inorganic Chemistry, 2003, 42, 4160-4164 |
4313805 | CIF | As1.33 Co2.22 H1.57 O6.33 | P 63 m c | 12.8279; 12.8279; 5.0919 90; 90; 120 | 725.64 | Robert W. Hughes; Lee A. Gerrard; Daniel J. Price; Mark T. Weller A Hybrid Metalloarsenate 3D Framework-1D Interrupted Metal Oxide Inorganic Chemistry, 2003, 42, 4160-4164 |
4321633 | CIF | As2 Cl2 Hg6 S8 | P 63 m c | 7.431; 7.431; 9.003 90; 90; 120 | 430.5 | Johannes Beck; Sylvia Hedderich; Klaus Köllisch Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure Inorganic Chemistry, 2000, 39, 5847-5850 |
4321634 | CIF | As2 Br2 Hg6 S8 | P 63 m c | 7.43; 7.43; 9.364 90; 90; 120 | 447.7 | Johannes Beck; Sylvia Hedderich; Klaus Köllisch Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure Inorganic Chemistry, 2000, 39, 5847-5850 |
4321635 | CIF | As Br Hg3 Se4 | P 63 m c | 7.707; 7.707; 9.468 90; 90; 120 | 487 | Johannes Beck; Sylvia Hedderich; Klaus Köllisch Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure Inorganic Chemistry, 2000, 39, 5847-5850 |
4321636 | CIF | As Hg3 I Se4 | P 63 m c | 7.6902; 7.6902; 9.9675 90; 90; 120 | 510.5 | Johannes Beck; Sylvia Hedderich; Klaus Köllisch Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure Inorganic Chemistry, 2000, 39, 5847-5850 |
4326533 | CIF | B3 Co Rh6 | P 63 m c | 7.43; 7.43; 4.7427 90; 90; 120 | 226.74 | Patrick R. N. Misse; Michael Gilleßen; Boniface P. T. Fokwa Site-Preferential Design of Itinerant Ferromagnetic Borides: Experimental and Theoretical Investigation of MRh6B3 (M = Fe, Co) Inorganic Chemistry, 2011, 50, 10303-10309 |
4328014 | CIF | C12 H24 Cl N O3 Sn | P 63 m c | 10.3357; 10.3357; 8.3534 90; 90; 120 | 772.81 | Thomas Zöller; Christina Dietz; Ljuba Iovkova-Berends; Olga Karsten; Gerrit Bradtmöller; Ann-Kristin Wiegand; Yu Wang; Viatcheslav Jouikov; Klaus Jurkschat Novel Stannatranes of the Type N(CH2CMe2O)3SnX (X = OR, SR, OC(O)R, SP(S)Ph2, Halogen). Synthesis, Molecular Structures, and Electrochemical Properties Inorganic Chemistry, 2012, 51, 1041-1056 |
4329871 | CIF | C43 H54 Ni6 O3 | P 63 m c | 15.637; 15.637; 9.351 90; 90; 120 | 1980.1 | Włodzimierz Buchowicz; Beata Herbaczyńska; Lucjan B. Jerzykiewicz; Tadeusz Lis; Stanisław Pasynkiewicz; Antoni Pietrzykowski Triple C-H Bond Activation of a Nickel-Bound Methyl Group: Synthesis and X-Ray Structure of a Carbide Cluster (NiCp)6(μ6-C) Inorganic Chemistry, 2012, 51, 8292-8297 |
4330025 | CIF | B5 Ca3 Ce1.5 La1.5 O15 | P 63 m c | 10.50502; 10.50502; 6.38831 90; 90; 120 | 610.535 | Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation Inorganic Chemistry, 2012, 51, 8802-8809 |
4330026 | CIF | B5 Ca3 Ce0.9 La2.1 O15 | P 63 m c | 10.5065; 10.5065; 6.40123 90; 90; 120 | 611.942 | Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation Inorganic Chemistry, 2012, 51, 8802-8809 |
4330027 | CIF | B5 Ca3 Ce0.3 La2.7 O15 | P 63 m c | 10.50803; 10.50803; 6.41329 90; 90; 120 | 613.273 | Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation Inorganic Chemistry, 2012, 51, 8802-8809 |
4330028 | CIF | B5 Ca3 Ce0.2 La2.8 O15 | P 63 m c | 10.51116; 10.51116; 6.41455 90; 90; 120 | 613.759 | Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation Inorganic Chemistry, 2012, 51, 8802-8809 |
4330029 | CIF | B5 Ca3 Ce0.1 La2.9 O15 | P 63 m c | 10.509484; 10.509484; 6.418076 90; 90; 120 | 613.901 | Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation Inorganic Chemistry, 2012, 51, 8802-8809 |
4330030 | CIF | B5 Ca3 La3 O15 | P 63 m c | 10.50975; 10.50975; 6.41935 90; 90; 120 | 614.054 | Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation Inorganic Chemistry, 2012, 51, 8802-8809 |
4332713 | CIF | C8 H20 Br4 Fe N | P 63 m c | 8.3774; 8.3774; 13.631 90; 90; 120 | 828.5 | Rohde, Jan-Uwe; Stubna, Audria; Bominaar, Emile L.; Münck, Eckard; Nam, Wonwoo; Que, Lawrence Nonheme Oxoiron(IV) Complexes of Tris(2-pyridylmethyl)amine withcis-Monoanionic Ligands Inorganic Chemistry, 2006, 45, 6435-6445 |
4334358 | CIF | C40 H90 Ce3 O11 | P 63 m c | 18.116; 18.116; 10.989 90; 90; 120 | 3123.3 | Johannes Schläfer; Stefan Stucky; Wieland Tyrra; Sanjay Mathur Heterobi- and Trimetallic Cerium(IV) tert-Butoxides with Mono-, Di-, and Trivalent Metals (M= K(I), Ge(II), Sn(II), Pb(II), Al(III), Fe(III)) Inorganic Chemistry, 2013, 52, 4002-4010 |
4335640 | CIF | C H5 I3 N2 Pb | P 63 m c | 8.6603; 8.6603; 7.9022 90; 90; 120 | 513.27 | Constantinos C. Stoumpos; Christos D. Malliakas; Mercouri G. Kanatzidis Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties Inorganic Chemistry, 2013, 52, 9019-9038 |
4340466 | CIF | C8 Ca5 Cs Na5 O24 | P 63 m c | 10.0845; 10.0845; 12.7055 90; 90; 120 | 1119 | Luo, Min; Wang, GenXiang; Lin, Chensheng; Ye, Ning; Zhou, Yuqiao; Cheng, Wendan Na4La2(CO3)5 and CsNa5Ca5(CO3)8: Two New Carbonates as UV Nonlinear Optical Materials. Inorganic chemistry, 2014, 53, 8098 |
4340467 | CIF | C5 La2 Na4 O15 | P 63 m c | 10.55; 10.55; 6.47 90; 90; 120 | 624 | Luo, Min; Wang, GenXiang; Lin, Chensheng; Ye, Ning; Zhou, Yuqiao; Cheng, Wendan Na4La2(CO3)5 and CsNa5Ca5(CO3)8: Two New Carbonates as UV Nonlinear Optical Materials. Inorganic chemistry, 2014, 53, 8098 |
4341700 | CIF | Ba2 Ga8 S16 Si | P 63 m c | 10.866; 10.866; 11.919 90; 90; 120 | 1218.7 | Liu, Bin-Wen; Zeng, Hui-Yi; Zhang, Ming-Jian; Fan, Yu-Hang; Guo, Guo-Cong; Huang, Jin-Shun; Dong, Zhen-Chao Syntheses, Structures, and Nonlinear-Optical Properties of Metal Sulfides Ba2Ga8MS16 (M = Si, Ge). Inorganic chemistry, 2015, 54, 976-981 |
4341701 | CIF | Ba2 Ga8 Ge S16 | P 63 m c | 10.8868; 10.8868; 11.9152 90; 90; 120 | 1223.02 | Liu, Bin-Wen; Zeng, Hui-Yi; Zhang, Ming-Jian; Fan, Yu-Hang; Guo, Guo-Cong; Huang, Jin-Shun; Dong, Zhen-Chao Syntheses, Structures, and Nonlinear-Optical Properties of Metal Sulfides Ba2Ga8MS16 (M = Si, Ge). Inorganic chemistry, 2015, 54, 976-981 |
4342327 | CIF | Al Ca3 Na3 Sb4 | P 63 m c | 10.0121; 10.0121; 7.6045 90; 90; 120 | 660.16 | Wang, Yi; Stoyko, Stanislav; Bobev, Svilen Quaternary Pnictides with Complex, Noncentrosymmetric Structures. Synthesis and Structural Characterization of the New Zintl Phases Na11Ca2Al3Sb8, Na4CaGaSb3, and Na15Ca3In5Sb12. Inorganic chemistry, 2015, 54, 1931-1939 |
4342920 | CIF | O6 Rb Sc Se2 | P 63 m c | 5.5929; 5.5929; 12.2326 90; 90; 120 | 331.378 | Song, Seung Yoon; Ok, Kang Min Modulation of Framework and Centricity: Cation Size Effect in New Quaternary Selenites, ASc(SeO3)2 (A = Na, K, Rb, and Cs). Inorganic chemistry, 2015, 54, 5032-5038 |
4343168 | CIF | C3 H3 B O16 Pb7 | P 63 m c | 10.519; 10.519; 8.9 90; 90; 120 | 852.8 | Abudoureheman, Maierhaba; Wang, Li; Zhang, Xianming; Yu, Hongwei; Yang, Zhihua; Lei, Chen; Han, Jian; Pan, Shilie Pb7O(OH)3(CO3)3(BO3): First Mixed Borate and Carbonate Nonlinear Optical Material Exhibiting Large Second-Harmonic Generation Response. Inorganic chemistry, 2015, 54, 4138-4142 |
4343181 | CIF | Cs F3 O9 Se2 Ti3 | P 63 m c | 7.242; 7.242; 11.8152 90; 90; 120 | 536.65 | Cao, Xue-Li; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao Cs(TaO2)3(SeO3)2 and Cs(TiOF)3(SeO3)2: Structural and Second Harmonic Generation Changes Induced by the Different d(0)-TM Coordination Octahedra. Inorganic chemistry, 2015, 54, 3875-3882 |
4343381 | CIF | Ca Fe O S | P 63 m c | 3.7519; 3.7519; 11.349 90; 90; 120 | 138.354 | Delacotte, Charlène; Pérez, Olivier; Pautrat, Alain; Berthebaud, David; Hébert, Sylvie; Suard, Emmanuelle; Pelloquin, Denis; Maignan, Antoine Magnetodielectric Effect in Crystals of the Noncentrosymmetric CaOFeS at Low Temperature. Inorganic chemistry, 2015, 54, 6560-6565 |
4344372 | CIF | Ir Si3 | P 63 m c | 4.351; 4.351; 6.622 90; 90; 120 | 108.567 | White, J.G.; Hockings, E.F. Crystal Structure of Iridium Trisilicide, Ir Si3 Inorganic Chemistry, 1971, 10, 1934-1935 |
4344484 | CIF | Al5.1 Ba44.52 Cu23.23 O83.84 | P 63 m c | 13.1524; 13.1524; 17.3122 90; 90; 120 | 2593.54 | VerNooy, P.D.; Dixon, M.A.; Stacy, A.M.; Hollander, F.J. Novel Cu6 O15 "bowls" in seven new barium copper oxides: M6 Ba46 Cu24 O84 (M= Al, Si, TI, Fe, Ga, Ge, Zr) Inorganic Chemistry, 1990, 29, 2837-2841 |
4344956 | CIF | C2 H8 I3 N Sn | P 63 m c | 8.966; 8.966; 23.079 90; 90; 120 | 1606.7 | Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D.; Kanatzidis, Mercouri G. Structure-Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites. Inorganic chemistry, 2017, 56, 56-73 |
4344991 | CIF | B3 Fe0.86 Rh5.12 Ru1.02 | P 63 m c | 7.4396; 7.4396; 4.742 90; 90; 120 | 227.3 | Shankhari, Pritam; Misse, Patrick R. N.; Mbarki, Mohammed; Park, Hyounmyung; Fokwa, Boniface P. T. Chemical Tuning of Magnetic Properties through Ru/Rh Substitution in Th7Fe3-type FeRh6-nRunB3 (n = 1-5) Series. Inorganic chemistry, 2016 |
4349390 | CIF | B12 Cs H12 Na | P 63 m c | 7.6227; 7.6227; 12.280488 90; 90; 120 | 617.97 | Sadikin, Yolanda; Schouwink, Pascal; Brighi, Matteo; Łodziana, Zbigniew; Černý, Radovan Modified Anion Packing of Na<sub>2</sub>B<sub>12</sub>H<sub>12</sub> in Close to Room Temperature Superionic Conductors. Inorganic chemistry, 2017, 56, 5006-5016 |
4349391 | CIF | B12 H12 K0.41 Li1.59 | P 63 m c | 7.0722; 7.0722; 11.9592 90; 90; 120 | 518.01 | Sadikin, Yolanda; Schouwink, Pascal; Brighi, Matteo; Łodziana, Zbigniew; Černý, Radovan Modified Anion Packing of Na<sub>2</sub>B<sub>12</sub>H<sub>12</sub> in Close to Room Temperature Superionic Conductors. Inorganic chemistry, 2017, 56, 5006-5016 |
4500111 | CIF | C15 H36 Cu3 Mo N7 O4 S3 | P 63 m c | 13.5715; 13.5715; 8.7125 90; 90; 120 | 1389.7 | Zhang, Jinfang; Meng, Suci; Song, Yinglin; Zhou, Yimeng; Cao, Yuan; Li, Jianghua; Zhao, Huajian; Hu, Jingchun; Wu, Jinhua; Humphrey, Mark G.; Zhang, Chi Syntheses, Structural, Theoretical, and Nonlinear Optical Studies of Non-Interpenetrating Three-Dimensional Nest-Shaped-Cluster [MoOS3Cu3]-Based Coordination Polymers Crystal Growth & Design, 2011, 11, 100 |
4506372 | CIF | B3.65 Ba3.12 F3.05 O10.95 Sr3.88 | P 63 m c | 10.87255; 10.87255; 6.94718 90; 90; 120 | 711.22 | Rashchenko, S. V.; Bekker, T. B.; Bakakin, V. V.; Seryotkin, Yu. V.; Shevchenko, V. S.; Kokh, A. E.; Stonoga, S. Yu. New Fluoride Borate Solid‒Solution Series Ba4‒xSr3+x(BO3)4‒yF2+3y Crystal Growth & Design, 2012, 12, 2955 |
4509252 | CIF | B3 Ba3 F5 O9 Sr4 | P 63 m c | 10.8953; 10.8953; 6.9381 90; 90; 120 | 713.3 | Zhang, Guochun; Liu, Zuoliang; Zhang, Jianxiu; Fan, Feidi; Liu, Youchen; Fu, Peizhen Crystal Growth, Structure, and Properties of a Non-Centrosymmetric Fluoride Borate, Ba3Sr4(BO3)3F5 Crystal Growth & Design, 2009, 9, 3137 |
4513415 | CIF | Al2 Ba3.259 Cu0.667 Nd2 O10 Sr0.073 | P 63 m c | 11.5255; 11.5255; 6.9634 90; 90; 120 | 801.072 | Scavini, M.; Mele, P.; Costa, G.A.; Ferretti, M. Growth and structural characterization of needlelike metastable crystals in the Nd-Ba-Cu-(Al)-O system Crystal Growth and Design, 2004, 4, 1259-1263 |
4514294 | CIF | C5 Ca4 Na2 O15 | P 63 m c | 10.37402; 10.37402; 6.25935 90; 90; 120 | 583.383 | Rashchenko, Sergey V.; Bakakin, Vladimir V.; Shatskiy, Anton F.; Gavryushkin, Pavel N.; Seryotkin, Yurii V.; Litasov, Konstantin D. Noncentrosymmetric Na2Ca4(CO3)5 Carbonate of “M13M23XY3Z” Structural Type and Affinity between Borate and Carbonate Structures for Design of New Optical Materials Crystal Growth & Design, 2017, 17, 6079 |
4515349 | CIF | C42 H21 N3 O16 Zr3 | P 63 m c | 23.3072; 23.3072; 21.8206 90; 90; 120 | 10265.4 | He, Tao; Zhang, Yong-Zheng; Kong, Xiang-Jing; Yu, Jiamei; Lv, Xiu-Liang; Wu, Yufeng; Guo, Zhen-Ji; Li, Jian-Rong Zr(IV)-Based Metal-Organic Framework with T-Shaped Ligand: Unique Structure, High Stability, Selective Detection, and Rapid Adsorption of Cr<sub>2</sub>O<sub>7</sub><sup>2-</sup> in Water. ACS applied materials & interfaces, 2018, 10, 16650-16659 |
4515449 | CIF | C45 H30 Br Co3 N15 O7 | P 63 m c | 16.6968; 16.6968; 18.9684 90; 90; 120 | 4579.6 | Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities. ACS applied materials & interfaces, 2019, 11, 3181-3188 |
4515450 | CIF | C46 H30 Co3 N16 O7 S | P 63 m c | 16.8384; 16.8384; 19.0516 90; 90; 120 | 4678 | Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities. ACS applied materials & interfaces, 2019, 11, 3181-3188 |
4515451 | CIF | C45 H30 Co3 N16 O10 | P 63 m c | 16.7567; 16.7567; 19.0343 90; 90; 120 | 4628.5 | Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities. ACS applied materials & interfaces, 2019, 11, 3181-3188 |
4515452 | CIF | C63 H42 B Co3 F4 N15 O7 | P 63 m c | 16.7599; 16.7599; 29.0651 90; 90; 120 | 7070.4 | Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities. ACS applied materials & interfaces, 2019, 11, 3181-3188 |
4515453 | CIF | C63 H42 Co3 N16 O10 | P 63 m c | 16.6267; 16.6267; 28.9795 90; 90; 120 | 6938 | Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities. ACS applied materials & interfaces, 2019, 11, 3181-3188 |
5910170 | CIF | Cd2 Mo3 O8 | P 63 m c | 5.835; 5.835; 10.815 90; 90; 120 | 318.889 | Wyckoff, R. W. G. Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 3, 467-467 |
5910193 | CIF | Mo3 O8 Zn2 | P 63 m c | 5.775; 5.775; 9.915 90; 90; 120 | 286.37 | Wyckoff, R. W. G. Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 3, 467-467 |
5910201 | CIF | C3 Al7 N3 | P 63 m c | 3.226; 3.226; 31.7 90; 90; 120 | 285.706 | Wyckoff, R. W. G. Pages 9 & 10 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 4, 9-10 |
5910206 | CIF | Mn2 Mo3 O8 | P 63 m c | 5.795; 5.795; 10.267 90; 90; 120 | 298.594 | Wyckoff, R. W. G. Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 3, 467-467 |
5910226 | CIF | Mo3 Ni2 O8 | P 63 m c | 5.752; 5.752; 9.865 90; 90; 120 | 282.661 | Wyckoff, R. W. G. Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 3, 467-467 |
5910324 | CIF | Co2 Mo3 O8 | P 63 m c | 5.767; 5.767; 9.915 90; 90; 120 | 285.577 | Wyckoff, R. W. G. Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals, 1951, 3, 467-467 |
6000373 | CIF | Li Mo2 O8 Tl3 | P 63 m c | 6.0039; 6.0039; 15.8203 90; 90; 120 | 493.87 | Xuriguera, A. M.; Justin, C. C.; Elfakir, A.; Quarton, M. Crystal and powder neutron diffraction data of Tl3Li(MO4)(2) (M = Mo, W) Powder Diffraction, 1998, 13, 244-245 |
6000374 | CIF | Li O8 Tl3 W2 | P 63 m c | 6.0348; 6.0348; 15.8176 90; 90; 120 | 498.89 | Xuriguera, A. M.; Justin, C. C.; Elfakir, A.; Quarton, M. Crystal and powder neutron diffraction data of Tl3Li(MO4)(2) (M = Mo, W) Powder Diffraction, 1998, 13, 244-245 |
7014819 | CIF | C4 H22.4 Cu K N4 O11.2 Zn | P 63 m c | 8.2737; 8.2737; 13.4002 90; 90; 120 | 794.4 | Dan, Hiroki; Nishikiori, Shin-ichi; Yamamuro, Osamu Tridymite-like host clathrate [K(H2O)n][CuZn(CN)4]: crystal structure, guest molecular motion and properties. Dalton transactions (Cambridge, England : 2003), 2011, 40, 1168-1174 |
7022774 | CIF | C9 H8.92 Co N3 O4.38 | P 63 m c | 15.9295; 15.9295; 19.72 90; 90; 120 | 4333.5 | Aharen, Tomoko; Habib, Fatemah; Korobkov, Ilia; Burchell, Tara J.; Guillet-Nicolas, Rémy; Kleiz, Fredy; Murugesu, Muralee Novel Co-based metal-organic frameworks and their magnetic properties using asymmetrically binding 4-(4'-carboxyphenyl)-1,2,4-triazole. Dalton transactions (Cambridge, England : 2003), 2013, 42, 7795-7802 |
7023550 | CIF | As Cl4 Ga Hg3 S | P 63 m c | 7.2447; 7.2447; 11.96 90; 90; 120 | 543.6 | Jiang, Xiao-Ming; Li, Xiao-Guo; Fan, Yu-Hang; Liu, Bin-Wen; Zeng, Hui-Yi; Guo, Guo-Cong New mercury-contained cationic frameworks stabilized by (GaCl4)(-) unit via weak electrostatic forces in supramolecular compounds (Hg11P4)(GaCl4)4 and (Hg3AsS)(GaCl4). Dalton transactions (Cambridge, England : 2003), 2013, 42, 15475-15481 |
7026499 | CIF | K O7 Sb Zn4 | P 63 m c | 6.141; 6.141; 9.948 90; 90; 120 | 324.9 | Yang, Song-Lin; Cheng, Wen-Dan; Zhang, Hao; Lin, Chen-Sheng; Zhang, Wei-Long; He, Zhang-Zhen KZn(4)SbO(7) and KZn(4)Sb(3)O(12): syntheses, structures and photophysics of Sb(5+) control materials. Dalton transactions (Cambridge, England : 2003), 2010, 39, 9547-9553 |
7027413 | CIF | C6 H6 Br4 Cu4 N6 | P 63 m c | 14.247; 14.247; 6.415 90; 90; 120 | 1127.6 | Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Cooke, Paul A.; Deveson, Anne M.; Fenske, Dieter; Hubberstey, Peter; Li, Wan-Sheung; Schröder, Martin Controlling copper(I) halide framework formation using N-donor bridging ligand symmetry: use of 1,3,5-triazine to construct architectures with threefold symmetry Journal of the Chemical Society, Dalton Transactions, 1999, 2103 |
7032014 | CIF | C6 H15 Sb Se | P 63 m c | 9.2201; 9.2201; 6.5289 90; 90; 120 | 480.66 | Heimann, Stefan; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan The bonding situation in triethylchalcogenostiboranes - polarized single bonds vs. double bonds. Dalton transactions (Cambridge, England : 2003), 2014, 43, 14772-14777 |
7035138 | CIF | Co12 H10.18 Na1.82 O38 P8 | P 63 m c | 12.63; 12.63; 5.017 90; 90; 120 | 693.1 | Yakubovich, Olga V.; Kiriukhina, Galina V.; Dimitrova, Olga V.; Shvanskaya, Larisa V.; Volkova, Olga S.; Vasiliev, Alexander N. A novel cobalt sodium phosphate hydroxide with the ellenbergerite topology: crystal structure and physical properties. Dalton transactions (Cambridge, England : 2003), 2015, 44, 11827-11834 |
7038805 | CIF | C45 H30 Co3 N15 O7 | P 63 m c | 16.679; 16.679; 19.05 90; 90; 120 | 4589.5 | Gao, Qiang; Zhao, Xiao-Lin; Chang, Ze; Xu, Jian; Bu, Xian-He Structural stabilization of a metal-organic framework for gas sorption investigation. Dalton transactions (Cambridge, England : 2003), 2016, 45, 6830-6833 |
7038905 | CIF | B4 Na3 O12 Y3 | P 63 m c | 10.1136; 10.1136; 6.7485 90; 90; 120 | 597.79 | Shan, Faxian; Kang, Lei; Zhang, Guochun; Yao, Jiyong; Lin, Zheshuai; Xia, Mingjun; Zhang, Xinyuan; Fu, Ying; Wu, Yicheng Na3Y3(BO3)4: a new noncentrosymmetric borate with an open-framework structure. Dalton transactions (Cambridge, England : 2003), 2016, 45, 7205-7208 |
7043283 | CIF | C15 H30 N3 O19 V6 | P 63 m c | 12.9234; 12.9234; 9.8515 90; 90; 120 | 1424.91 | Wei, Yongge; Xiao, Zicheng; Hu, Xunliang; Hu, Xiaokang; Huang, Bo; Cheng, Min; Wu, Pingfan; Lin, Xinjun Syntheses and post-functionalization of tri-substituted polyalkoxohexavanadates containing tris(alkoxo) ligands Dalton Trans., 2017 |
7047696 | CIF | C6 H15 Br6 N2 O0.5 Pb | P 63 m c | 9.7459; 9.7459; 14.2773 90; 90; 120 | 1174.41 | Song, Jun-Ling; Chen, Wen-Jun; Chu, Kai-Bin; Zhou, Yu-Hua A facile synthesis of two new IR optical perovskites based on 1,4-diazabicyclo[2,2,2]octane with a high laser damage threshold. Dalton transactions (Cambridge, England : 2003), 2018, 47, 14497-14502 |
7055226 | CIF | B5 Ca3 Nd3 O15 | P 63 m c | 10.4864; 10.4864; 6.2665 90; 90; 120 | 596.772 | Wang, Xing; Xia, Mingjun; Li, R. K. Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties New J. Chem., 2016, 40, 2057 |
7062929 | CIF | H4.2 Mn6.75 O18.845 V4 | P 63 m c | 13.1893; 13.1893; 5.2408 90; 90; 120 | 789.54 | Shvanskaya, Larisa V.; Krikunova, Polina V.; Vasilchikova, Tatyana M.; Borovikova, Elena Y.; Volkova, Olga S.; Vasiliev, Alexander N. Crystal structure, infrared spectroscopy and thermodynamic properties of a manganese member of the ellenbergerite family New Journal of Chemistry, 2024, 48, 1952-1957 |
7100128 | CIF | N Na Sn | P 63 m c | 3.3306; 3.3306; 10.8919 90; 90; 120 | 104.636 | Simon Clarke; Oltan Gal; Nicholas Watney; D. Webster; Simon J. Clarke The first ternary tin (II) nitride: NaSnN Chemical Communications, 2005 |
7102512 | CIF | C24 H54 Br2 Ni2 S2 Si2 | P 63 m c | 26.128; 26.128; 24.69 90; 90; 120 | 14597 | Sydora, Orson L; Wolczanski, Peter T; Lobkovsky, Emil B; Rumberger, Evan; Hendrickson, David N First row wheels, [((t)Bu(3)SiS)MX](12)(M = Co, X = Cl; M = Ni, X = Br), are common amongst both simpler and more complex aggregates. Chemical communications (Cambridge, England), 2004, 650-651 |
7105364 | CIF | ? | P 63 m c | 3.19868; 3.19868; 5.19278 90; 90; 120 | 46.0121 | Yashima, Masatomo; Yamada, Hiroki; Maeda, Kazuhiko; Domen, Kazunari Experimental visualization of covalent bonds and structural disorder in a gallium zinc oxynitride photocatalyst (Ga(1-x)Zn(x))(N(1-x)O(x)): origin of visible light absorption. Chemical communications (Cambridge, England), 2010, 46, 2379-2381 |
7110615 | CIF | C79 H13 N | P 63 m c | 13.4643; 13.4643; 12.6983 90; 90; 120 | 1993.6 | Marc Veen, E.; Feringa, Ben L.; Postma, Peter M.; Jonkman, Harry T.; Spek, Anthony L. Solid state organisation of C60 by inclusion crystallisation with triptycenes† Chemical Communications, 1999, 1709 |
7118235 | CIF | C9 Bi Co3 O9 | P 63 m c | 11.094; 11.094; 7.301 90; 90; 120 | 778.197 | Martinengo, S.; Ciani, G. Bismuth-cobalt heteronuclear carbonyl cluster compounds. Synthesis and x-ray characteritation of the neutral Bi Co3 (C O)9 and of the paramagnetic anion (Bi2 Co4 (C O)11)- Journal of the Chemical Society. Chemical Communications (1972-), 1987, 1987, 1589-1591 |
7130145 | CIF | C36 H40 Co10 Cu4 I4 N4 O31 | P 63 m c | 19.6109; 19.6109; 31.97 90; 90; 120 | 10648 | Peng, Shuang; Li, Yan; Ge, Rui; Chen, Wen-Xin; Wang, Tian-Yu; Li, Xin-Xiong; Zheng, Shou-Tian Designed assembly of heterometallic zeolite-like framework materials from two different supertetrahedral metal clusters Chemical Communications, 2022 |
7209333 | CIF | Ag Dy Sn | P 63 m c | 4.683; 4.683; 7.344 90; 90; 120 | 139.48 | Sebastian, C.P.; Heymann, G.; Heying, B.; Riecken, J.F.; Huppertz, H.; Rodewald, U.C.; Hermes, W.; Schappacher, F.M.; Poettgen, R. The high-temperature modification of Lu Ag Sn and high-pressure high-temperature experiments on Dy Ag Sn, Ho Ag Sn, and Yb Ag Sn Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2008, 63, 193-198 |
7209338 | CIF | Ag Ho Sn | P 63 m c | 4.672; 4.672; 7.317 90; 90; 120 | 138.315 | Rodewald, U.C.; Sebastian, C.P.; Poettgen, R.; Hermes, W.; Heymann, G.; Schappacher, F.M.; Heying, B.; Riecken, J.F.; Huppertz, H. The high-temperature modification of Lu Ag Sn and high-pressure high-temperature experiments on Dy Ag Sn, Ho Ag Sn, and Yb Ag Sn Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2008, 63, 193-198 |
7209347 | CIF | Ag Lu Sn | P 63 m c | 4.635; 4.635; 7.232 90; 90; 120 | 134.551 | Hermes, W.; Rodewald, U.C.; Poettgen, R.; Schappacher, F.M.; Huppertz, H.; Sebastian, C.P.; Heymann, G.; Heying, B.; Riecken, J.F. The high-temperature modification of Lu Ag Sn and high-pressure high-temperature experiments on Dy Ag Sn, Ho Ag Sn, and Yb Ag Sn Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2008, 63, 193-198 |
7209380 | CIF | Au Ce Sn | P 63 m c | 4.727; 4.727; 7.716 90; 90; 120 | 149.312 | Poduska, K.M.; DiSalvo, F.J.; Mosel, B.D.; Trill, H.; Niepmann, D.; Poettgen, R. Structure and Properties of the Stannides CeAuSn, Ce3Rh4Sn13, and Ce3Ir4Sn13 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2001, 56, 1-8 |
7209416 | CIF | Au3 Li Sn4 | P 63 m c | 4.4831; 4.4831; 20.557 90; 90; 120 | 357.806 | Johrendt, D.; Wu Zhi-Yun; Poettgen, R.; Hoffmann, R.D. The stannides Li Au Sn and Li Au3 Sn4 - syntheses, structure and chemical bonding Journal of Materials Chemistry, 2002, 12, 676-680 |
7210067 | CIF | C H6 I N3 | P 63 m c | 7.1512; 7.1512; 11.963 90; 90; 120 | 529.82 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210068 | CIF | C H6 I N3 | P 63 m c | 7.1641; 7.1641; 12.0317 90; 90; 120 | 534.79 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210069 | CIF | C H6 I N3 | P 63 m c | 7.17619; 7.17619; 12.1229 90; 90; 120 | 540.66 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210070 | CIF | C H6 I N3 | P 63 m c | 7.18791; 7.18791; 12.229 90; 90; 120 | 547.176 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210071 | CIF | C H6 I N3 | P 63 m c | 7.19508; 7.19508; 12.2986 90; 90; 120 | 551.388 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210072 | CIF | C H6 I N3 | P 63 m c | 7.20163; 7.20163; 12.3501 90; 90; 120 | 554.706 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210073 | CIF | C H6 I N3 | P 63 m c | 7.20634; 7.20634; 12.402 90; 90; 120 | 557.77 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210074 | CIF | C H6 I N3 | P 63 m c | 7.21109; 7.21109; 12.461 90; 90; 120 | 561.16 | Szafrański, Marek; Jarek, Marcin Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide CrystEngComm, 2013, 15, 4617 |
7210708 | CIF | H2 In O6 P2 Rb | P 63 m c | 5.477; 5.477; 13.0083 90; 90; 120 | 337.94 | Wang, Xi-Jia; Zhang, Jian-Han; Song, Jun-Ling; Kong, Fang; Mao, Jiang-Gao Syntheses, crystal structures of a series of novel alkali metal or alkaline earth metal phosphites CrystEngComm, 2013, 15, 2519 |
7211469 | CIF | C6 H18 I6 N2 O Pb | P 63 m c | 10.1927; 10.1927; 14.8276 90; 90; 120 | 1334.07 | Wang, Guan-E; Jiang, Xiao-Ming; Zhang, Ming-Jian; Chen, Hui-Fen; Liu, Bin-Wen; Wang, Ming-Sheng; Guo, Guo-Cong Crystal structures and optical properties of iodoplumbates hybrids templated by in situ synthesized 1,4-diazabicyclo[2.2.2]octane derivatives CrystEngComm, 2013, 15, 10399 |
7212147 | CIF | C9 H20 Cl4 Fe N | P 63 m c | 8.223; 8.223; 13.03 90; 90; 120 | 763.02 | Krieger, Brenna M.; Lee, Heather Y.; Emge, Thomas J.; Wishart, James F.; Castner, Jr, Edward W Ionic liquids and solids with paramagnetic anions. Physical chemistry chemical physics : PCCP, 2010, 12, 8919-8925 |
7221102 | CIF | H3 Mn6.867 O18.801 V4 | P 63 m c | 13.2293; 13.2293; 5.25472 90; 90; 120 | 796.442 | Zhang, F.; Zavalii, P.Yu.; Whittingham, M.S. Synthesis and characterisation of a pipe-structure manganese vanadium oxide by hydrothermal reaction Journal of Materials Chemistry, 1999, 9, 3137-3140 |
7221255 | CIF | Be Li Sb | P 63 m c | 4.154; 4.154; 6.739 90; 90; 120 | 100.707 | Tiburtius, C.; Schuster, H.U. Li Be Sb und Li Zn Bi, ternaere Verbindungen mit Wurtzitgeruest Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986), 1978, 33, 35-38 |
7221256 | CIF | Bi Zn | P 63 m c | 4.576; 4.576; 7.377 90; 90; 120 | 133.777 | Tiburtius, C.; Schuster, H.U. Li Be Sb und Li Zn Bi, ternaere Verbindungen mit Wurtzitgeruest Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986), 1978, 33, 35-38 |
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 |
7222726 | CIF | Co Na6 S4 | P 63 m c | 8.909; 8.909; 6.878 90; 90; 120 | 472.771 | Klepp, K.O.; Bronger, W. Na6 Co S4 - ein Thiocobaltat mit isolierten Co S4-Anionen Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986), 1983, 38, 12-15 |
7222856 | CIF | Br Cu | P 63 m c | 4.06; 4.06; 6.66 90; 90; 120 | 95.073 | Krug, J.; Sieg, L. Die Struktur der Hochtemperatur-Modifikationen des Cu Br und Cu J Zeitschrift fuer Naturforschung, Teil A. Physikalische Chemie, Kosmophysik (2,1947-32,1977), 1952, 7, 369-371 |
7222858 | CIF | Cu I | P 63 m c | 4.31; 4.31; 7.09 90; 90; 120 | 114.059 | Krug, J.; Sieg, L. Die Struktur der Hochtemperatur-Modifikationen des Cu Br und Cu I Zeitschrift fuer Naturforschung, Teil A. Physikalische Chemie, Kosmophysik (2,1947-32,1977), 1952, 7, 369-371 |
7233714 | CIF | B3 Ba7 Cl O13 Si | P 63 m c | 11.195; 11.195; 7.263 90; 90; 120 | 788.3 | Xiaoxia Lin; Fangfang Zhang; Shilie Pan; Hongwei Yu; Fangyuan Zhang; Xiaoyu Dong; Shujuan Han; Lingyun Dong; Chunyan Bai; Zheng Wang Ba4(BO3)3(SiO4).Ba3X (X = Cl, Br): new salt-inclusion borosilicate halides as potential deep UV nonlinear optical materials Journal of Materials Chemistry C, 2014, 2, 4257-4264 |
7233715 | CIF | B3 Ba7 Br O13 Si | P 63 m c | 11.279; 11.279; 7.324 90; 90; 120 | 806.9 | Xiaoxia Lin; Fangfang Zhang; Shilie Pan; Hongwei Yu; Fangyuan Zhang; Xiaoyu Dong; Shujuan Han; Lingyun Dong; Chunyan Bai; Zheng Wang Ba4(BO3)3(SiO4).Ba3X (X = Cl, Br): new salt-inclusion borosilicate halides as potential deep UV nonlinear optical materials Journal of Materials Chemistry C, 2014, 2, 4257-4264 |
7234258 | CIF | Al N | P 63 m c | 3.081; 3.081; 5.031 90; 90; 120 | 41.359 | Hua Cai; Peipei Liang; Rene Hubner; Shengqiang Zhou; Yanli Li; Jian Sun; Ning Xu; Jiada Wu Composition and bandgap control of AlxGa1-xN films synthesized by plasma-assisted pulsed laser deposition Journal of Materials Chemistry C, 2015, 3, 5307-5315 |
7234259 | CIF | Ga N | P 63 m c | 3.1972; 3.1972; 5.207 90; 90; 120 | 46.1 | Hua Cai; Peipei Liang; Rene Hubner; Shengqiang Zhou; Yanli Li; Jian Sun; Ning Xu; Jiada Wu Composition and bandgap control of AlxGa1-xN films synthesized by plasma-assisted pulsed laser deposition Journal of Materials Chemistry C, 2015, 3, 5307-5315 |
7235037 | CIF | Cs H12 Mg O10 P | P 63 m c | 6.9099; 6.9099; 11.9332 90; 90; 120 | 493.44 | Yuqiao Zhou; Liling Cao; Chensheng Lin; Min Luo; Tao Yan; Ning Ye; Wendan Cheng AMgPO4.6H2O (A = Rb, Cs): strong SHG responses originated from orderly PO4 groups Journal of Materials Chemistry C, 2016, 4, 9219-9226 |
7236866 | CIF | C8 Ca5 Li0 Na6 O24 | P 63 m c | 10.0708; 10.0708; 12.604 90; 90; 120 | 1107 | Song, Yunxia; Luo, Min; Zhao, Dan; Peng, Guang; Lin, Chensheng; Ye, Ning Explorations of new UV nonlinear optical materials in the Na2CO3‒CaCO3system Journal of Materials Chemistry C, 2017, 5, 8758 |
7237622 | CIF | C3 H15 Bi2 I9 N6 | P 63 m c | 8.7119; 8.7119; 22.0141 90; 90; 120 | 1446.96 | Szklarz, Przemysław; Gągor, Anna; Jakubas, Ryszard; Zieliński, Piotr; Piecha-Bisiorek, Anna; Cichos, Jakub; Karbowiak, Mirosław; Bator, Grażyna; Ciżman, Agnieszka Lead-free hybrid ferroelectric material based on formamidine: [NH2CHNH2]3Bi2I9 Journal of Materials Chemistry C, 2019, 7, 3003 |
7243551 | CIF | C6 H18 Cl7 Cu7 S3 | P 63 m c | 13.9585; 13.9585; 6.4715 90; 90; 120 | 1091.98 | Goreshnik, Evgeny Influence of the synthetic conditions on a formation of 1-D, 2-D and 3-D copper–chloride coordination polymers CrystEngComm, 2021, 23, 7171-7178 |
7243558 | CIF | C6 H18 Cl7 Cu7 S3 | P 63 m c | 13.9585; 13.9585; 6.4715 90; 90; 120 | 1091.98 | Sun, Tingting; Lin, Shuang-Yan; Xu, Zhikun; Li, L. In-situ growth of Fe doped NiCo-MOF electrocatalyst from layered double hydroxide effectively enhances electrocatalytic oxygen evolution performance CrystEngComm, 2021 |
7247106 | CIF | Al O7 P2 | P 63 m c | 5.1806; 5.1806; 12.8377 90; 90; 120 | 298.39 | Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures CrystEngComm, 2023, 25, 4864-4872 |
7248509 | CIF | C4 H12 Br P | P 63 m c | 7.02188; 7.02188; 10.03217 90; 90; 120 | 428.383 | Gawraczynski, Jakub; Leszczynski, Piotr J.; Cyranski, Michal Ksawery; Dobrzycki, Łukasz; Koźmiński, Wiktor; Fijalkowski, Karol J.; Grochala, Wojciech; Jaroń, Tomasz Synthesis and structural trends in a series of simple tetraalkylphosphonium salts CrystEngComm, 2024 |
8100406 | CIF | Cu8 Eu3 Sn4 | P 63 m c | 9.251; 9.251; 7.801 90; 90; 120 | 578.2 | Fornasini, Maria L.; Manfrinetti, Pietro; Mazzone, Donata Crystal structure of trieuropium octacopper tetrastannide, Eu~3~Cu~8~Sn~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 279-280 |
8103547 | CIF | Cl2 H12 O14 Zn | P 63 m c | 7.715; 7.715; 5.22 90; 90; 120 | 269.075 | Ghosh, M.; Ray, S. Twinning and disorder in zinc perchlorate hexahydrate crystaL Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1977, 145, 146-154 |
8103548 | CIF | Cl2 Fe H12 O14 | P 63 m c | 7.815; 7.815; 5.13 90; 90; 120 | 271.335 | Ghosh, M.; Ray, S. Twinning, disorder and phase transition in ferrous perchlorate hexahydrate crystals Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979), 1981, 155, 129-137 |
8103854 | CIF | Cl3 N Pr4 S3 | P 63 m c | 9.269; 9.269; 6.882 90; 90; 120 | 512.048 | Schleid, T.; Meyer, M. Cystal structure of tetrapraseodymium(III) nitride trisulfide trichloride , Pr4 N S3 Cl3 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 187-187 |
8103908 | CIF | Ga Na3 P4 Sr3 | P 63 m c | 9.373; 9.373; 7.371 90; 90; 120 | 560.808 | Somer, M.; von Schnering, H.G.; Carillo-Cabrera, W.; Peters, K.; Nuss, J.; Cordier, G. Crystal structures of trisodium tristrontium tetrapnictidogallates, Na3 Sr3 Ga P4, Na3 Sr3 Ga As4 and Na3 Sr3 Ga Sb4 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 479-480 |
8103909 | CIF | As4 Ga Na3 Sr3 | P 63 m c | 9.603; 9.603; 7.53 90; 90; 120 | 601.367 | Somer, M.; Carillo-Cabrera, W.; Peters, K.; Nuss, J.; von Schnering, H.G.; Cordier, G. Crystal structures of trisodium tristrontium tetrapnictidogallates, Na3 Sr3 Ga P4, Na3 Sr3 Ga As4 and Na3 Sr3 Ga Sb4 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 479-480 |
8103912 | CIF | Al As4 Ca3 Na3 | P 63 m c | 9.399; 9.399; 7.21 90; 90; 120 | 551.606 | Somer, M.; Carrillo-Cabrera, W.; von Schnering, H.G.; Peters, K.; Cordier, G. Crystal structure of trisodium tetraarsenidoaluminate, Na3 Ca3 Al As4 Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 550-550 |
8104241 | CIF | Mn Na6 S4 | P 63 m c | 9.036; 9.036; 6.96 90; 90; 120 | 492.144 | Bronger, W.; Balk-Hardtdegen, H.; Muller, P. Zusammenhaenge zwischen Struktur und magnetischen Eigenschaften von Manganverbindungen mit tetraedrisch koordinierten Mn(II) Zeitschrift fuer Kristallographie (149,1979-), 1988, 182, 47-49 |
8104257 | CIF | Br2 Cd | P 63 m c | 3.985; 3.985; 12.561 90; 90; 120 | 172.747 | Mitchell, R.S. Single crystal x-ray study of structural polytypism in cadmium bromide Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1962, 117, 309-318 |
9000010 | CIF | Be4 Na O7 Sb | P 63 m c | 5.47; 5.47; 8.92 90; 90; 120 | 231.137 | Pauling, L.; Klug, H. P.; Winchell, A. N. The crystal structure of swedenborgite, NaBe4SbO7 American Mineralogist, 1935, 20, 492-501 |
9000085 | CIF | S Zn | P 63 m c | 3.824; 3.824; 31.2 90; 90; 120 | 395.113 | Evans, H. T.; McKnight, E. T. New wurtzite polytypes from Joplin, Missouri American Mineralogist, 1959, 44, 1210-1218 |
9000086 | CIF | S Zn | P 63 m c | 3.82; 3.82; 24.96 90; 90; 120 | 315.429 | Evans, H. T.; McKnight, E. T. New wurtzite polytypes from Joplin, Missouri American Mineralogist, 1959, 44, 1210-1218 |
9000563 | CIF | Al K O3.996 Si | P 63 m c | 5.153; 5.153; 8.682 90; 90; 120 | 199.651 | Dollase, W. A.; Freeborn, W. P. The structure of KAlSiO4 with P6_3mc symmetry Note: natural sample of kalsilite was mixed with powdered KCl and heated, it tranformed to this phase American Mineralogist, 1977, 62, 336-340 |
9000846 | CIF | Al7.29 Fe2.21 H Mg0.7 O16 Ti0.5 Zn0.3 | P 63 m c | 5.734; 5.734; 18.389 90; 90; 120 | 523.605 | Gatehouse, B. M.; Grey, I. E. The crystal structure of hogbomite-8H American Mineralogist, 1982, 67, 373-380 |
9000891 | CIF | Al0.15 Fe1.1 H O8 Ti0.3 V3.45 | P 63 m c | 5.89; 5.89; 9.255 90; 90; 120 | 278.059 | Gatehouse, B. M.; Grey, I. E.; Nickel, E. H. The crystal chemistry of nolanite, (V,Fe,Ti,Al)10O14(OH)2, from Kalgoorlie, Western Australia sample: crystal # 1 American Mineralogist, 1983, 68, 833-839 |
9000892 | CIF | Al0.1 Fe1.75 H O8 Ti0.55 V2.6 | P 63 m c | 5.89; 5.89; 9.255 90; 90; 120 | 278.059 | Gatehouse, B. M.; Grey, I. E.; Nickel, E. H. The crystal chemistry of nolanite, (V,Fe,Ti,Al)10O14(OH)2, from Kalgoorlie, Western Australia sample: crystal # 2 American Mineralogist, 1983, 68, 833-839 |
9002666 | CIF | Al12 H Mg4 O24 Ti | P 63 m c | 5.7; 5.7; 27.6 90; 90; 120 | 776.586 | Hejny, C.; Armbruster, T. Polysomatism in hogbomite: The crystal structures of 10T, 12H, 14T and 24R polysomes Note: Data represents a model, not experiment. Sample: polytype 12H American Mineralogist, 2002, 87, 277-292 |
9004178 | CIF | O Zn | P 63 m c | 3.2494; 3.2494; 5.2038 90; 90; 120 | 47.584 | Kihara, K.; Donnay, G. Anharmonic thermal vibrations in ZnO Model: 2-c, at T = 293 K The Canadian Mineralogist, 1985, 23, 647-654 |
9004179 | CIF | O Zn | P 63 m c | 3.2533; 3.2533; 5.2073 90; 90; 120 | 47.73 | Kihara, K.; Donnay, G. Anharmonic thermal vibrations in ZnO Model: 2-c, at T = 473 K The Canadian Mineralogist, 1985, 23, 647-654 |
9004180 | CIF | O Zn | P 63 m c | 3.2494; 3.2494; 5.2038 90; 90; 120 | 47.584 | Kihara, K.; Donnay, G. Anharmonic thermal vibrations in ZnO Model: 3-c, at T = 293 K The Canadian Mineralogist, 1985, 23, 647-654 |
9004181 | CIF | O Zn | P 63 m c | 3.2533; 3.2533; 5.2073 90; 90; 120 | 47.73 | Kihara, K.; Donnay, G. Anharmonic thermal vibrations in ZnO Model: 3-c, at T = 473 K The Canadian Mineralogist, 1985, 23, 647-654 |
9004615 | CIF | Be4 Ca0.04 Na0.89 O7 Sb | P 63 m c | 5.4317; 5.4317; 8.8571 90; 90; 120 | 226.305 | Huminicki, D. M. C.; Hawthorne, F. C. Refinement of the crystal structure of swedenborgite The Canadian Mineralogist, 2001, 39, 153-158 |
9004664 | CIF | Fe1.77 H Mg1.26 Mn0.16 O8 Sb Zn0.81 | P 63 m c | 5.9889; 5.9889; 9.353 90; 90; 120 | 290.52 | Holtstam, D.; Gatedal, K.; Soderberg, K.; Norrestam, R. Rinmanite, Zn2Sb2Mg2Fe4O14(OH)2, a new mineral species with a nolanite-type structure from the Garpenberg Norra mine, Dalarna, Sweden The Canadian Mineralogist, 2001, 39, 1675-1683 |
9005508 | CIF | As2.268 Fe5.07 H9.492 O15.246 Si0.246 Zn0.9 | P 63 m c | 12.773; 12.773; 5.051 90; 90; 120 | 713.664 | Keller, P. Ekatite, (Fe3+,Fe2+,Zn)12(OH)6[AsO3]6[AsO3,HOSiO3]2, a new mineral from Tsumeb, Namibia, and its crystal structure European Journal of Mineralogy, 2001, 13, 769-777 |
9005562 | CIF | Al7 Fe2.6 H Mg O16 Ti0.4 | P 63 m c | 5.712; 5.712; 18.317 90; 90; 120 | 517.561 | Hejny, C.; Gnos, E.; Grobety, B.; Armbruster, T. Crystal chemistry of the polysome ferrohogbomite-2N2S, a long-known but newly defined mineral species European Journal of Mineralogy, 2002, 14, 957-967 |
9007714 | CIF | Fe2 Mo3 O8 | P 63 m c | 5.781; 5.781; 10.06 90; 90; 120 | 291.162 | Kanazawa, Y.; Sasaki, A. Structure of kamiokite Note: anisoB's taken from ICSD Acta Crystallographica, Section C, 1986, 42, 9-11 |
9007906 | CIF | Fe0.05 Mn0.95 S | P 63 m c | 3.982; 3.982; 6.445 90; 90; 120 | 88.503 | Eriksson, L.; Kalinowski, M. P. Mn1-xFexS, x=0.05, an example of an anti-wurtzite structure Acta Crystallographica, Section E, 2001, 57, i92-i93 |
9008031 | CIF | Cl H6 Li O7 | P 63 m c | 7.71; 7.71; 5.42 90; 90; 120 | 279.022 | West, C. D. Crystal structures of some hydrated compounds Zeitschrift fur Kristallographie, 1934, 88, 198-204 |
9008032 | CIF | H6 I Li O3 | P 63 m c | 7.45; 7.45; 5.45 90; 90; 120 | 261.963 | West, C. D. Crystal structures of some hydrated compounds Zeitschrift fur Kristallographie, 1934, 88, 198-204 |
9008263 | CIF | C2 Ca K0.36 Na1.64 O6 | P 63 m c | 5.05; 5.05; 12.85 90; 90; 120 | 283.803 | McKie, D.; Frankis, E. J. Nyerereite: A new volcanic carbonate mineral from Oldoinyo Lengai, Tanzania Note: high-temperature polymorph with an structure that has been inferred Zeitschrift fur Kristallographie, 1977, 145, 73-95 |
9008569 | CIF | C | P 63 m c | 2.456; 2.456; 6.696 90; 90; 120 | 34.979 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 7-83 |
9008859 | CIF | Ag I | P 63 m c | 4.58; 4.58; 7.494 90; 90; 120 | 136.137 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008860 | CIF | Al N | P 63 m c | 3.111; 3.111; 4.978 90; 90; 120 | 41.724 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008861 | CIF | Be O | P 63 m c | 2.698; 2.698; 4.38 90; 90; 120 | 27.611 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008862 | CIF | Cd S | P 63 m c | 4.1348; 4.1348; 6.749 90; 90; 120 | 99.926 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008863 | CIF | Cd Se | P 63 m c | 4.3; 4.3; 7.02 90; 90; 120 | 112.41 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008864 | CIF | Br Cu | P 63 m c | 4.06; 4.06; 6.66 90; 90; 120 | 95.073 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008865 | CIF | Cl Cu | P 63 m c | 3.91; 3.91; 6.42 90; 90; 120 | 85 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008866 | CIF | Cu H | P 63 m c | 2.893; 2.893; 4.614 90; 90; 120 | 33.443 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008867 | CIF | Cu I | P 63 m c | 4.31; 4.31; 7.09 90; 90; 120 | 114.059 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008868 | CIF | Ga N | P 63 m c | 3.18; 3.18; 5.166 90; 90; 120 | 45.242 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008869 | CIF | In N | P 63 m c | 3.533; 3.533; 5.693 90; 90; 120 | 61.54 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008870 | CIF | Mg Te | P 63 m c | 4.52; 4.52; 7.33 90; 90; 120 | 129.691 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008871 | CIF | Mn S | P 63 m c | 3.976; 3.976; 6.432 90; 90; 120 | 88.058 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008872 | CIF | Mn Se | P 63 m c | 4.12; 4.12; 6.72 90; 90; 120 | 98.786 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008873 | CIF | Mn Te | P 63 m c | 4.087; 4.087; 6.701 90; 90; 120 | 96.935 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008874 | CIF | N Nb | P 63 m c | 3.017; 3.017; 5.58 90; 90; 120 | 43.986 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008875 | CIF | C Si | P 63 m c | 3.076; 3.076; 5.048 90; 90; 120 | 41.364 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008876 | CIF | N Ta | P 63 m c | 3.05; 3.05; 4.94 90; 90; 120 | 39.798 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008877 | CIF | O Zn | P 63 m c | 3.2495; 3.2495; 5.2069 90; 90; 120 | 47.615 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008878 | CIF | S Zn | P 63 m c | 3.811; 3.811; 6.234 90; 90; 120 | 78.411 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008879 | CIF | Se Zn | P 63 m c | 3.98; 3.98; 6.53 90; 90; 120 | 89.58 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008880 | CIF | Te Zn | P 63 m c | 4.27; 4.27; 6.99 90; 90; 120 | 110.373 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: wurtzite structure Crystal Structures, 1963, 1, 85-237 |
9008883 | CIF | Au Sn | P 63 m c | 4.314; 4.314; 5.512 90; 90; 120 | 88.838 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008884 | CIF | Co S | P 63 m c | 3.367; 3.367; 5.16 90; 90; 120 | 50.66 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008885 | CIF | Co Sb | P 63 m c | 3.866; 3.866; 5.188 90; 90; 120 | 67.151 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008886 | CIF | Co Se | P 63 m c | 3.6294; 3.6294; 5.3006 90; 90; 120 | 60.468 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008887 | CIF | Co Te | P 63 m c | 3.886; 3.886; 5.36 90; 90; 120 | 70.097 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008888 | CIF | Cr S | P 63 m c | 3.448; 3.448; 5.754 90; 90; 120 | 59.243 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008889 | CIF | Cr Sb | P 63 m c | 4.108; 4.108; 5.44 90; 90; 120 | 79.504 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008890 | CIF | Cr Se | P 63 m c | 3.684; 3.684; 6.019 90; 90; 120 | 70.745 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008891 | CIF | Cr Te | P 63 m c | 3.981; 3.981; 6.211 90; 90; 120 | 85.246 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008892 | CIF | Cu Sn | P 63 m c | 4.19; 4.19; 5.086 90; 90; 120 | 77.328 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008893 | CIF | Fe S | P 63 m c | 3.43; 3.43; 5.68 90; 90; 120 | 57.872 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008894 | CIF | Fe Sb | P 63 m c | 4.06; 4.06; 5.13 90; 90; 120 | 73.232 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008895 | CIF | Fe Se | P 63 m c | 3.637; 3.637; 5.958 90; 90; 120 | 68.252 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008896 | CIF | Fe Te | P 63 m c | 3.8; 3.8; 5.651 90; 90; 120 | 70.668 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008897 | CIF | Ir Te | P 63 m c | 3.939; 3.939; 5.386 90; 90; 120 | 72.372 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008898 | CIF | As Mn | P 63 m c | 3.71; 3.71; 5.691 90; 90; 120 | 67.837 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008899 | CIF | Bi Mn | P 63 m c | 4.3; 4.3; 6.12 90; 90; 120 | 97.998 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008900 | CIF | Mn Sb | P 63 m c | 4.12; 4.12; 5.784 90; 90; 120 | 85.026 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008901 | CIF | Mn Te | P 63 m c | 4.1429; 4.1429; 6.7031 90; 90; 120 | 99.636 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008902 | CIF | As Ni | P 63 m c | 3.602; 3.602; 5.009 90; 90; 120 | 56.282 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008903 | CIF | Ni Sb | P 63 m c | 3.94; 3.94; 5.14 90; 90; 120 | 69.101 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008904 | CIF | Ni Se | P 63 m c | 3.6613; 3.6613; 5.3562 90; 90; 120 | 62.181 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008905 | CIF | Ni Sn | P 63 m c | 4.048; 4.048; 5.123 90; 90; 120 | 72.7 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008906 | CIF | Ni Te | P 63 m c | 3.957; 3.957; 5.354 90; 90; 120 | 72.601 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008907 | CIF | Pd Sb | P 63 m c | 4.07; 4.07; 5.582 90; 90; 120 | 80.077 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008908 | CIF | Pd Sn | P 63 m c | 4.378; 4.378; 5.627 90; 90; 120 | 93.403 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008909 | CIF | Pd Te | P 63 m c | 4.1521; 4.1521; 5.6719 90; 90; 120 | 84.683 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008910 | CIF | B Pt | P 63 m c | 3.358; 3.358; 4.058 90; 90; 120 | 39.628 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008911 | CIF | Bi Pt | P 63 m c | 4.315; 4.315; 5.49 90; 90; 120 | 88.525 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008912 | CIF | Pt Sb | P 63 m c | 4.13; 4.13; 5.472 90; 90; 120 | 80.831 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008913 | CIF | Pt Sn | P 63 m c | 4.103; 4.103; 5.428 90; 90; 120 | 79.136 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008914 | CIF | Bi Rh | P 63 m c | 4.094; 4.094; 5.663 90; 90; 120 | 82.2 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008915 | CIF | Rh Sn | P 63 m c | 4.34; 4.34; 5.555 90; 90; 120 | 90.614 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008916 | CIF | Rh Te | P 63 m c | 3.99; 3.99; 5.66 90; 90; 120 | 78.036 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008917 | CIF | Sc Te | P 63 m c | 4.122; 4.122; 6.735 90; 90; 120 | 99.102 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008918 | CIF | S Ti | P 63 m c | 3.3; 3.3; 6.44 90; 90; 120 | 60.736 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008919 | CIF | Se Ti | P 63 m c | 3.559; 3.559; 6.22 90; 90; 120 | 68.23 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008920 | CIF | Te Ti | P 63 m c | 3.834; 3.834; 6.39 90; 90; 120 | 81.346 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008921 | CIF | P V | P 63 m c | 3.18; 3.18; 6.22 90; 90; 120 | 54.472 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008922 | CIF | S V | P 63 m c | 3.36; 3.36; 5.813 90; 90; 120 | 56.834 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008923 | CIF | Se V | P 63 m c | 3.58; 3.58; 5.977 90; 90; 120 | 66.341 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008924 | CIF | Te V | P 63 m c | 3.942; 3.942; 6.126 90; 90; 120 | 82.441 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9008925 | CIF | Te Zr | P 63 m c | 3.953; 3.953; 6.647 90; 90; 120 | 89.952 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure Crystal Structures, 1963, 1, 85-237 |
9009138 | CIF | Cd I2 | P 63 m c | 4.24; 4.24; 13.67 90; 90; 120 | 212.829 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
9009139 | CIF | Cd Cl H O | P 63 m c | 3.66; 3.66; 10.27 90; 90; 120 | 119.142 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
9009140 | CIF | I2 Pb | P 63 m c | 4.557; 4.557; 13.958 90; 90; 120 | 251.022 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 239-444 |
9009239 | CIF | Ni S | P 63 m c | 3.4456; 3.4456; 5.405 90; 90; 120 | 55.572 | Trahan, J.; Goodrich, R. G.; Watkins, S. F. X-ray diffraction measurements on metallic and semiconducting hexagonal NiS Note: T = 77 K Physical Review B, 1970, 2, 2859-2863 |
9009303 | CIF | Al8 Be Mg3 O16 | P 63 m c | 5.6867; 5.6867; 18.337 90; 90; 120 | 513.546 | Nuber, B.; Schmetzer, K. Crystal structure of ternary Be-Mg-Al oxides: taaffeite, BeMg3Al8O16, and musgravite, BeMg2Al6O12 Note: formerly known as taaffeite-8H Neues Jahrbuch fur Mineralogie, Monatshefte, 1983, 1983, 393-402 |
9009728 | CIF | Al K O4 Si | P 63 m c | 5.3; 5.3; 8.65 90; 90; 120 | 210.426 | Kawahara, A.; Andou, Y.; Marumo, F.; Okuno, M. The crystal structure of high temperature form of kalsilite (KAlSiO4) at 950 C Note: B(1,2)'s corrected to obey symmetry restrictions Note: Synthetic sample Note: x(O1) adjusted to match reported bond lengths Mineralogical Journal, 1987, 13, 260-270 |
9009861 | CIF | Hg K6 S4 | P 63 m c | 9.98; 9.98; 7.64 90; 90; 120 | 658.999 | Sommer, H.; Hoppe, R.; Jansen, M. Das erste thiomercurat(II) mit inselstruktur: K6(HgS4) Die Naturwissenschaften, 1976, 63, 194-195 |
9009951 | CIF | C5 Ba0.318 Ca0.834 Ce0.222 La0.114 Na2.184 Nd0.048 O15 Pr0.018 Sr1.899 Y0.03 | P 63 m c | 10.5313; 10.5313; 6.4829 90; 90; 120 | 622.679 | Belovitskaya Yu, V.; Pekov, I. V.; Kabalov Yu, K. Refinement of the crystal structures of low-rare-earth and "typical" burbankites by the Rietveld method Sample: B-108 Note: x02 adjusted to satisfy symmetry constraints Crystallography Reports, 2000, 45, 26-29 |
9009952 | CIF | C5 Ba0.378 Ca1.131 Ce0.018 La0.051 Na1.86 O15 Sr2.151 Y0.018 | P 63 m c | 10.5263; 10.5263; 6.5392 90; 90; 120 | 627.49 | Belovitskaya Yu, V.; Pekov, I. V.; Kabalov Yu, K. Refinement of the crystal structures of low-rare-earth and "typical" burbankites by the Rietveld method Sample: B-104 Crystallography Reports, 2000, 45, 26-29 |
9009987 | CIF | Al10 H2 O16 | P 63 m c | 5.575; 5.575; 8.761 90; 90; 120 | 235.816 | Yamaguchi, G.; Okumiya, M.; Ono, S. Refinement of the structure of tohdite 5Al2O3*H2O Bulletin of the Chemical Society of Japan, 1969, 42, 2247-2249 |
9010158 | CIF | C Si | P 63 m c | 3.081; 3.081; 15.1248 90; 90; 120 | 124.338 | Capitani, G. C.; Di Pierro, S.; Tempesta, G. The 6H-SiC structure model: Further refinement from SCXRD data from a terrestrial moissanite American Mineralogist, 2007, 92, 403-407 |
9010518 | CIF | Fe0.25 Mn0.25 S Zn0.5 | P 63 m c | 3.881; 3.881; 6.315 90; 90; 120 | 82.374 | Mloszewski, M. J.; Saha, A. K.; Nuffield, E. W. Manganoan ferroan wurtzite from Llallagua, Bolivia (II) The Canadian Mineralogist, 1957, 6, 136-139 |
9010609 | CIF | O8 Si Sn6 | P 63 m c | 7.3742; 7.3742; 11.9598 90; 90; 120 | 563.228 | Locock, A. J.; Ramik, R. A.; Back, M. E. The structures of two novel Sn2+ oxysalts found with romarchite and hydroromarchite as corrosion products of pewter artifacts The Canadian Mineralogist, 2006, 44, 1457-1467 |
9010611 | CIF | Cu6 Ge S8 W | P 63 m c | 7.5238; 7.5238; 12.39 90; 90; 120 | 607.402 | Putz, H.; Paar, W. H.; Topa, D.; Makovicky, E.; Roberts, A. C. Catamarcaite, Cu6GeWS8, a new germanium sulfide mineral species from Capillitas, Catamarca, Argentina: Description, paragenesis and crystal structure Locality: Capillitas, Catamarca, Argentina The Canadian Mineralogist, 2006, 44, 1481-1497 |
9010636 | CIF | F6 K2 Si | P 63 m c | 5.6461; 5.6461; 9.2322 90; 90; 120 | 254.878 | Gramaccioli, C. M.; Campostrini, I. Demartinite, a new polymorph of K2SiF6 from La Fossa Crater, Vulcano, Aeolian Islands, Italy Locality: La Fossa Crater, Vulcano Island, Aeolian Archipelago, Sicily, Italy The Canadian Mineralogist, 2007, 45, 1275-1280 |
9011571 | CIF | Fe4.93 H O8 | P 63 m c | 5.928; 5.928; 9.126 90; 90; 120 | 277.733 | Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B. The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd6 Science, 2007, 316, 1726-1729 |
9011572 | CIF | Fe4.87 H O8 | P 63 m c | 5.953; 5.953; 9.096 90; 90; 120 | 279.16 | Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B. The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd3 Science, 2007, 316, 1726-1729 |
9011573 | CIF | Fe4.75 H O8 | P 63 m c | 5.958; 5.958; 8.965 90; 90; 120 | 275.602 | Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B. The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd2 Science, 2007, 316, 1726-1729 |
9011657 | CIF | Al N | P 63 m c | 3.11; 3.11; 4.98 90; 90; 120 | 41.714 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
9011658 | CIF | Ga N | P 63 m c | 3.19; 3.19; 5.189 90; 90; 120 | 45.729 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
9011659 | CIF | Be O | P 63 m c | 2.698; 2.698; 4.38 90; 90; 120 | 27.611 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
9011660 | CIF | B N | P 63 m c | 2.536; 2.536; 4.199 90; 90; 120 | 23.387 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
9011661 | CIF | C Si | P 63 m c | 3.076; 3.076; 5.048 90; 90; 120 | 41.364 | Xu, Y. N.; Ching, W. Y. Electronic, optical, and structural properties of some wurtzite crystals Physical Review B, 1993, 48, 4335-4351 |
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