Crystallography Open Database

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4343181 CIFCs F3 O9 Se2 Ti3P 63 m c7.242; 7.242; 11.8152
90; 90; 120
536.65Cao, 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 CIFCa Fe O SP 63 m c3.7519; 3.7519; 11.349
90; 90; 120
138.354Delacotte, 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 CIFIr Si3P 63 m c4.351; 4.351; 6.622
90; 90; 120
108.567White, J.G.; Hockings, E.F.
Crystal Structure of Iridium Trisilicide, Ir Si3
Inorganic Chemistry, 1971, 10, 1934-1935
4344484 CIFAl5.1 Ba44.52 Cu23.23 O83.84P 63 m c13.1524; 13.1524; 17.3122
90; 90; 120
2593.54VerNooy, 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 CIFC2 H8 I3 N SnP 63 m c8.966; 8.966; 23.079
90; 90; 120
1606.7Stoumpos, 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 CIFB3 Fe0.86 Rh5.12 Ru1.02P 63 m c7.4396; 7.4396; 4.742
90; 90; 120
227.3Shankhari, 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 CIFB12 Cs H12 NaP 63 m c7.6227; 7.6227; 12.280488
90; 90; 120
617.97Sadikin, 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 CIFB12 H12 K0.41 Li1.59P 63 m c7.0722; 7.0722; 11.9592
90; 90; 120
518.01Sadikin, 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 CIFC15 H36 Cu3 Mo N7 O4 S3P 63 m c13.5715; 13.5715; 8.7125
90; 90; 120
1389.7Zhang, 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 CIFB3.65 Ba3.12 F3.05 O10.95 Sr3.88P 63 m c10.87255; 10.87255; 6.94718
90; 90; 120
711.22Rashchenko, 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 CIFB3 Ba3 F5 O9 Sr4P 63 m c10.8953; 10.8953; 6.9381
90; 90; 120
713.3Zhang, 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 CIFAl2 Ba3.259 Cu0.667 Nd2 O10 Sr0.073P 63 m c11.5255; 11.5255; 6.9634
90; 90; 120
801.072Scavini, 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 CIFC5 Ca4 Na2 O15P 63 m c10.37402; 10.37402; 6.25935
90; 90; 120
583.383Rashchenko, 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 CIFC42 H21 N3 O16 Zr3P 63 m c23.3072; 23.3072; 21.8206
90; 90; 120
10265.4He, 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 CIFC45 H30 Br Co3 N15 O7P 63 m c16.6968; 16.6968; 18.9684
90; 90; 120
4579.6Brunet, 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 CIFC46 H30 Co3 N16 O7 SP 63 m c16.8384; 16.8384; 19.0516
90; 90; 120
4678Brunet, 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 CIFC45 H30 Co3 N16 O10P 63 m c16.7567; 16.7567; 19.0343
90; 90; 120
4628.5Brunet, 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 CIFC63 H42 B Co3 F4 N15 O7P 63 m c16.7599; 16.7599; 29.0651
90; 90; 120
7070.4Brunet, 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 CIFC63 H42 Co3 N16 O10P 63 m c16.6267; 16.6267; 28.9795
90; 90; 120
6938Brunet, 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 CIFCd2 Mo3 O8P 63 m c5.835; 5.835; 10.815
90; 90; 120
318.889Wyckoff, 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 CIFMo3 O8 Zn2P 63 m c5.775; 5.775; 9.915
90; 90; 120
286.37Wyckoff, 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 CIFC3 Al7 N3P 63 m c3.226; 3.226; 31.7
90; 90; 120
285.706Wyckoff, 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 CIFMn2 Mo3 O8P 63 m c5.795; 5.795; 10.267
90; 90; 120
298.594Wyckoff, 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 CIFMo3 Ni2 O8P 63 m c5.752; 5.752; 9.865
90; 90; 120
282.661Wyckoff, 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 CIFCo2 Mo3 O8P 63 m c5.767; 5.767; 9.915
90; 90; 120
285.577Wyckoff, 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 CIFLi Mo2 O8 Tl3P 63 m c6.0039; 6.0039; 15.8203
90; 90; 120
493.87Xuriguera, 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 CIFLi O8 Tl3 W2P 63 m c6.0348; 6.0348; 15.8176
90; 90; 120
498.89Xuriguera, 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 CIFC4 H22.4 Cu K N4 O11.2 ZnP 63 m c8.2737; 8.2737; 13.4002
90; 90; 120
794.4Dan, 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 CIFC9 H8.92 Co N3 O4.38P 63 m c15.9295; 15.9295; 19.72
90; 90; 120
4333.5Aharen, 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 CIFAs Cl4 Ga Hg3 SP 63 m c7.2447; 7.2447; 11.96
90; 90; 120
543.6Jiang, 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 CIFK O7 Sb Zn4P 63 m c6.141; 6.141; 9.948
90; 90; 120
324.9Yang, 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 CIFC6 H6 Br4 Cu4 N6P 63 m c14.247; 14.247; 6.415
90; 90; 120
1127.6Blake, 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 CIFC6 H15 Sb SeP 63 m c9.2201; 9.2201; 6.5289
90; 90; 120
480.66Heimann, 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 CIFCo12 H10.18 Na1.82 O38 P8P 63 m c12.63; 12.63; 5.017
90; 90; 120
693.1Yakubovich, 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 CIFC45 H30 Co3 N15 O7P 63 m c16.679; 16.679; 19.05
90; 90; 120
4589.5Gao, 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 CIFB4 Na3 O12 Y3P 63 m c10.1136; 10.1136; 6.7485
90; 90; 120
597.79Shan, 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 CIFC15 H30 N3 O19 V6P 63 m c12.9234; 12.9234; 9.8515
90; 90; 120
1424.91Wei, 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 CIFC6 H15 Br6 N2 O0.5 PbP 63 m c9.7459; 9.7459; 14.2773
90; 90; 120
1174.41Song, 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 CIFB5 Ca3 Nd3 O15P 63 m c10.4864; 10.4864; 6.2665
90; 90; 120
596.772Wang, 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 CIFH4.2 Mn6.75 O18.845 V4P 63 m c13.1893; 13.1893; 5.2408
90; 90; 120
789.54Shvanskaya, 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 CIFN Na SnP 63 m c3.3306; 3.3306; 10.8919
90; 90; 120
104.636Simon Clarke; Oltan Gal; Nicholas Watney; D. Webster; Simon J. Clarke
The first ternary tin (II) nitride: NaSnN
Chemical Communications, 2005
7102512 CIFC24 H54 Br2 Ni2 S2 Si2P 63 m c26.128; 26.128; 24.69
90; 90; 120
14597Sydora, 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 c3.19868; 3.19868; 5.19278
90; 90; 120
46.0121Yashima, 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 CIFC79 H13 NP 63 m c13.4643; 13.4643; 12.6983
90; 90; 120
1993.6Marc 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 CIFC9 Bi Co3 O9P 63 m c11.094; 11.094; 7.301
90; 90; 120
778.197Martinengo, 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 CIFC36 H40 Co10 Cu4 I4 N4 O31P 63 m c19.6109; 19.6109; 31.97
90; 90; 120
10648Peng, 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 CIFAg Dy SnP 63 m c4.683; 4.683; 7.344
90; 90; 120
139.48Sebastian, 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 CIFAg Ho SnP 63 m c4.672; 4.672; 7.317
90; 90; 120
138.315Rodewald, 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 CIFAg Lu SnP 63 m c4.635; 4.635; 7.232
90; 90; 120
134.551Hermes, 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 CIFAu Ce SnP 63 m c4.727; 4.727; 7.716
90; 90; 120
149.312Poduska, 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 CIFAu3 Li Sn4P 63 m c4.4831; 4.4831; 20.557
90; 90; 120
357.806Johrendt, 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 CIFC H6 I N3P 63 m c7.1512; 7.1512; 11.963
90; 90; 120
529.82Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210068 CIFC H6 I N3P 63 m c7.1641; 7.1641; 12.0317
90; 90; 120
534.79Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210069 CIFC H6 I N3P 63 m c7.17619; 7.17619; 12.1229
90; 90; 120
540.66Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210070 CIFC H6 I N3P 63 m c7.18791; 7.18791; 12.229
90; 90; 120
547.176Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210071 CIFC H6 I N3P 63 m c7.19508; 7.19508; 12.2986
90; 90; 120
551.388Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210072 CIFC H6 I N3P 63 m c7.20163; 7.20163; 12.3501
90; 90; 120
554.706Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210073 CIFC H6 I N3P 63 m c7.20634; 7.20634; 12.402
90; 90; 120
557.77Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210074 CIFC H6 I N3P 63 m c7.21109; 7.21109; 12.461
90; 90; 120
561.16Szafrański, Marek; Jarek, Marcin
Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide
CrystEngComm, 2013, 15, 4617
7210708 CIFH2 In O6 P2 RbP 63 m c5.477; 5.477; 13.0083
90; 90; 120
337.94Wang, 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 CIFC6 H18 I6 N2 O PbP 63 m c10.1927; 10.1927; 14.8276
90; 90; 120
1334.07Wang, 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 CIFC9 H20 Cl4 Fe NP 63 m c8.223; 8.223; 13.03
90; 90; 120
763.02Krieger, 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 CIFH3 Mn6.867 O18.801 V4P 63 m c13.2293; 13.2293; 5.25472
90; 90; 120
796.442Zhang, 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 CIFBe Li SbP 63 m c4.154; 4.154; 6.739
90; 90; 120
100.707Tiburtius, 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 CIFBi ZnP 63 m c4.576; 4.576; 7.377
90; 90; 120
133.777Tiburtius, 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 CIFN7 Si4 Sr YP 63 m c5.997; 5.997; 9.659
90; 90; 120
300.837Fang, 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 CIFBa N7 Si4 YP 63 m c6.021; 6.021; 9.803
90; 90; 120
307.77Fang, 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 CIFCo Na6 S4P 63 m c8.909; 8.909; 6.878
90; 90; 120
472.771Klepp, 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 CIFBr CuP 63 m c4.06; 4.06; 6.66
90; 90; 120
95.073Krug, 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 CIFCu IP 63 m c4.31; 4.31; 7.09
90; 90; 120
114.059Krug, 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 CIFB3 Ba7 Cl O13 SiP 63 m c11.195; 11.195; 7.263
90; 90; 120
788.3Xiaoxia 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 CIFB3 Ba7 Br O13 SiP 63 m c11.279; 11.279; 7.324
90; 90; 120
806.9Xiaoxia 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 CIFAl NP 63 m c3.081; 3.081; 5.031
90; 90; 120
41.359Hua 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 CIFGa NP 63 m c3.1972; 3.1972; 5.207
90; 90; 120
46.1Hua 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 CIFCs H12 Mg O10 PP 63 m c6.9099; 6.9099; 11.9332
90; 90; 120
493.44Yuqiao 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 CIFC8 Ca5 Li0 Na6 O24P 63 m c10.0708; 10.0708; 12.604
90; 90; 120
1107Song, 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 CIFC3 H15 Bi2 I9 N6P 63 m c8.7119; 8.7119; 22.0141
90; 90; 120
1446.96Szklarz, 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 CIFC6 H18 Cl7 Cu7 S3P 63 m c13.9585; 13.9585; 6.4715
90; 90; 120
1091.98Goreshnik, 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 CIFC6 H18 Cl7 Cu7 S3P 63 m c13.9585; 13.9585; 6.4715
90; 90; 120
1091.98Sun, 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 CIFAl O7 P2P 63 m c5.1806; 5.1806; 12.8377
90; 90; 120
298.39Hao, 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 CIFC4 H12 Br PP 63 m c7.02188; 7.02188; 10.03217
90; 90; 120
428.383Gawraczynski, 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 CIFCu8 Eu3 Sn4P 63 m c9.251; 9.251; 7.801
90; 90; 120
578.2Fornasini, 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 CIFCl2 H12 O14 ZnP 63 m c7.715; 7.715; 5.22
90; 90; 120
269.075Ghosh, 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 CIFCl2 Fe H12 O14P 63 m c7.815; 7.815; 5.13
90; 90; 120
271.335Ghosh, 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 CIFCl3 N Pr4 S3P 63 m c9.269; 9.269; 6.882
90; 90; 120
512.048Schleid, 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 CIFGa Na3 P4 Sr3P 63 m c9.373; 9.373; 7.371
90; 90; 120
560.808Somer, 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 CIFAs4 Ga Na3 Sr3P 63 m c9.603; 9.603; 7.53
90; 90; 120
601.367Somer, 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 CIFAl As4 Ca3 Na3P 63 m c9.399; 9.399; 7.21
90; 90; 120
551.606Somer, 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 CIFMn Na6 S4P 63 m c9.036; 9.036; 6.96
90; 90; 120
492.144Bronger, 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 CIFBr2 CdP 63 m c3.985; 3.985; 12.561
90; 90; 120
172.747Mitchell, 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 CIFBe4 Na O7 SbP 63 m c5.47; 5.47; 8.92
90; 90; 120
231.137Pauling, L.; Klug, H. P.; Winchell, A. N.
The crystal structure of swedenborgite, NaBe4SbO7
American Mineralogist, 1935, 20, 492-501
9000085 CIFS ZnP 63 m c3.824; 3.824; 31.2
90; 90; 120
395.113Evans, H. T.; McKnight, E. T.
New wurtzite polytypes from Joplin, Missouri
American Mineralogist, 1959, 44, 1210-1218
9000086 CIFS ZnP 63 m c3.82; 3.82; 24.96
90; 90; 120
315.429Evans, H. T.; McKnight, E. T.
New wurtzite polytypes from Joplin, Missouri
American Mineralogist, 1959, 44, 1210-1218
9000563 CIFAl K O3.996 SiP 63 m c5.153; 5.153; 8.682
90; 90; 120
199.651Dollase, 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 CIFAl7.29 Fe2.21 H Mg0.7 O16 Ti0.5 Zn0.3P 63 m c5.734; 5.734; 18.389
90; 90; 120
523.605Gatehouse, B. M.; Grey, I. E.
The crystal structure of hogbomite-8H
American Mineralogist, 1982, 67, 373-380
9000891 CIFAl0.15 Fe1.1 H O8 Ti0.3 V3.45P 63 m c5.89; 5.89; 9.255
90; 90; 120
278.059Gatehouse, 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 CIFAl0.1 Fe1.75 H O8 Ti0.55 V2.6P 63 m c5.89; 5.89; 9.255
90; 90; 120
278.059Gatehouse, 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 CIFAl12 H Mg4 O24 TiP 63 m c5.7; 5.7; 27.6
90; 90; 120
776.586Hejny, 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 CIFO ZnP 63 m c3.2494; 3.2494; 5.2038
90; 90; 120
47.584Kihara, K.; Donnay, G.
Anharmonic thermal vibrations in ZnO Model: 2-c, at T = 293 K
The Canadian Mineralogist, 1985, 23, 647-654
9004179 CIFO ZnP 63 m c3.2533; 3.2533; 5.2073
90; 90; 120
47.73Kihara, K.; Donnay, G.
Anharmonic thermal vibrations in ZnO Model: 2-c, at T = 473 K
The Canadian Mineralogist, 1985, 23, 647-654
9004180 CIFO ZnP 63 m c3.2494; 3.2494; 5.2038
90; 90; 120
47.584Kihara, K.; Donnay, G.
Anharmonic thermal vibrations in ZnO Model: 3-c, at T = 293 K
The Canadian Mineralogist, 1985, 23, 647-654
9004181 CIFO ZnP 63 m c3.2533; 3.2533; 5.2073
90; 90; 120
47.73Kihara, K.; Donnay, G.
Anharmonic thermal vibrations in ZnO Model: 3-c, at T = 473 K
The Canadian Mineralogist, 1985, 23, 647-654
9004615 CIFBe4 Ca0.04 Na0.89 O7 SbP 63 m c5.4317; 5.4317; 8.8571
90; 90; 120
226.305Huminicki, D. M. C.; Hawthorne, F. C.
Refinement of the crystal structure of swedenborgite
The Canadian Mineralogist, 2001, 39, 153-158
9004664 CIFFe1.77 H Mg1.26 Mn0.16 O8 Sb Zn0.81P 63 m c5.9889; 5.9889; 9.353
90; 90; 120
290.52Holtstam, 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 CIFAs2.268 Fe5.07 H9.492 O15.246 Si0.246 Zn0.9P 63 m c12.773; 12.773; 5.051
90; 90; 120
713.664Keller, 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 CIFAl7 Fe2.6 H Mg O16 Ti0.4P 63 m c5.712; 5.712; 18.317
90; 90; 120
517.561Hejny, 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 CIFFe2 Mo3 O8P 63 m c5.781; 5.781; 10.06
90; 90; 120
291.162Kanazawa, Y.; Sasaki, A.
Structure of kamiokite Note: anisoB's taken from ICSD
Acta Crystallographica, Section C, 1986, 42, 9-11
9007906 CIFFe0.05 Mn0.95 SP 63 m c3.982; 3.982; 6.445
90; 90; 120
88.503Eriksson, 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 CIFCl H6 Li O7P 63 m c7.71; 7.71; 5.42
90; 90; 120
279.022West, C. D.
Crystal structures of some hydrated compounds
Zeitschrift fur Kristallographie, 1934, 88, 198-204
9008032 CIFH6 I Li O3P 63 m c7.45; 7.45; 5.45
90; 90; 120
261.963West, C. D.
Crystal structures of some hydrated compounds
Zeitschrift fur Kristallographie, 1934, 88, 198-204
9008263 CIFC2 Ca K0.36 Na1.64 O6P 63 m c5.05; 5.05; 12.85
90; 90; 120
283.803McKie, 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 CIFCP 63 m c2.456; 2.456; 6.696
90; 90; 120
34.979Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York
Crystal Structures, 1963, 1, 7-83
9008859 CIFAg IP 63 m c4.58; 4.58; 7.494
90; 90; 120
136.137Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008860 CIFAl NP 63 m c3.111; 3.111; 4.978
90; 90; 120
41.724Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008861 CIFBe OP 63 m c2.698; 2.698; 4.38
90; 90; 120
27.611Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008862 CIFCd SP 63 m c4.1348; 4.1348; 6.749
90; 90; 120
99.926Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008863 CIFCd SeP 63 m c4.3; 4.3; 7.02
90; 90; 120
112.41Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008864 CIFBr CuP 63 m c4.06; 4.06; 6.66
90; 90; 120
95.073Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008865 CIFCl CuP 63 m c3.91; 3.91; 6.42
90; 90; 120
85Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008866 CIFCu HP 63 m c2.893; 2.893; 4.614
90; 90; 120
33.443Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008867 CIFCu IP 63 m c4.31; 4.31; 7.09
90; 90; 120
114.059Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008868 CIFGa NP 63 m c3.18; 3.18; 5.166
90; 90; 120
45.242Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008869 CIFIn NP 63 m c3.533; 3.533; 5.693
90; 90; 120
61.54Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008870 CIFMg TeP 63 m c4.52; 4.52; 7.33
90; 90; 120
129.691Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008871 CIFMn SP 63 m c3.976; 3.976; 6.432
90; 90; 120
88.058Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008872 CIFMn SeP 63 m c4.12; 4.12; 6.72
90; 90; 120
98.786Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008873 CIFMn TeP 63 m c4.087; 4.087; 6.701
90; 90; 120
96.935Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008874 CIFN NbP 63 m c3.017; 3.017; 5.58
90; 90; 120
43.986Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008875 CIFC SiP 63 m c3.076; 3.076; 5.048
90; 90; 120
41.364Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008876 CIFN TaP 63 m c3.05; 3.05; 4.94
90; 90; 120
39.798Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008877 CIFO ZnP 63 m c3.2495; 3.2495; 5.2069
90; 90; 120
47.615Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008878 CIFS ZnP 63 m c3.811; 3.811; 6.234
90; 90; 120
78.411Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008879 CIFSe ZnP 63 m c3.98; 3.98; 6.53
90; 90; 120
89.58Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008880 CIFTe ZnP 63 m c4.27; 4.27; 6.99
90; 90; 120
110.373Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: wurtzite structure
Crystal Structures, 1963, 1, 85-237
9008883 CIFAu SnP 63 m c4.314; 4.314; 5.512
90; 90; 120
88.838Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008884 CIFCo SP 63 m c3.367; 3.367; 5.16
90; 90; 120
50.66Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008885 CIFCo SbP 63 m c3.866; 3.866; 5.188
90; 90; 120
67.151Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008886 CIFCo SeP 63 m c3.6294; 3.6294; 5.3006
90; 90; 120
60.468Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008887 CIFCo TeP 63 m c3.886; 3.886; 5.36
90; 90; 120
70.097Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008888 CIFCr SP 63 m c3.448; 3.448; 5.754
90; 90; 120
59.243Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008889 CIFCr SbP 63 m c4.108; 4.108; 5.44
90; 90; 120
79.504Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008890 CIFCr SeP 63 m c3.684; 3.684; 6.019
90; 90; 120
70.745Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008891 CIFCr TeP 63 m c3.981; 3.981; 6.211
90; 90; 120
85.246Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008892 CIFCu SnP 63 m c4.19; 4.19; 5.086
90; 90; 120
77.328Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008893 CIFFe SP 63 m c3.43; 3.43; 5.68
90; 90; 120
57.872Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008894 CIFFe SbP 63 m c4.06; 4.06; 5.13
90; 90; 120
73.232Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008895 CIFFe SeP 63 m c3.637; 3.637; 5.958
90; 90; 120
68.252Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008896 CIFFe TeP 63 m c3.8; 3.8; 5.651
90; 90; 120
70.668Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008897 CIFIr TeP 63 m c3.939; 3.939; 5.386
90; 90; 120
72.372Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008898 CIFAs MnP 63 m c3.71; 3.71; 5.691
90; 90; 120
67.837Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008899 CIFBi MnP 63 m c4.3; 4.3; 6.12
90; 90; 120
97.998Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008900 CIFMn SbP 63 m c4.12; 4.12; 5.784
90; 90; 120
85.026Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008901 CIFMn TeP 63 m c4.1429; 4.1429; 6.7031
90; 90; 120
99.636Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008902 CIFAs NiP 63 m c3.602; 3.602; 5.009
90; 90; 120
56.282Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008903 CIFNi SbP 63 m c3.94; 3.94; 5.14
90; 90; 120
69.101Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008904 CIFNi SeP 63 m c3.6613; 3.6613; 5.3562
90; 90; 120
62.181Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008905 CIFNi SnP 63 m c4.048; 4.048; 5.123
90; 90; 120
72.7Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008906 CIFNi TeP 63 m c3.957; 3.957; 5.354
90; 90; 120
72.601Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008907 CIFPd SbP 63 m c4.07; 4.07; 5.582
90; 90; 120
80.077Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008908 CIFPd SnP 63 m c4.378; 4.378; 5.627
90; 90; 120
93.403Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008909 CIFPd TeP 63 m c4.1521; 4.1521; 5.6719
90; 90; 120
84.683Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008910 CIFB PtP 63 m c3.358; 3.358; 4.058
90; 90; 120
39.628Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008911 CIFBi PtP 63 m c4.315; 4.315; 5.49
90; 90; 120
88.525Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008912 CIFPt SbP 63 m c4.13; 4.13; 5.472
90; 90; 120
80.831Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008913 CIFPt SnP 63 m c4.103; 4.103; 5.428
90; 90; 120
79.136Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008914 CIFBi RhP 63 m c4.094; 4.094; 5.663
90; 90; 120
82.2Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008915 CIFRh SnP 63 m c4.34; 4.34; 5.555
90; 90; 120
90.614Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008916 CIFRh TeP 63 m c3.99; 3.99; 5.66
90; 90; 120
78.036Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008917 CIFSc TeP 63 m c4.122; 4.122; 6.735
90; 90; 120
99.102Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008918 CIFS TiP 63 m c3.3; 3.3; 6.44
90; 90; 120
60.736Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008919 CIFSe TiP 63 m c3.559; 3.559; 6.22
90; 90; 120
68.23Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008920 CIFTe TiP 63 m c3.834; 3.834; 6.39
90; 90; 120
81.346Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008921 CIFP VP 63 m c3.18; 3.18; 6.22
90; 90; 120
54.472Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008922 CIFS VP 63 m c3.36; 3.36; 5.813
90; 90; 120
56.834Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008923 CIFSe VP 63 m c3.58; 3.58; 5.977
90; 90; 120
66.341Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008924 CIFTe VP 63 m c3.942; 3.942; 6.126
90; 90; 120
82.441Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9008925 CIFTe ZrP 63 m c3.953; 3.953; 6.647
90; 90; 120
89.952Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure
Crystal Structures, 1963, 1, 85-237
9009138 CIFCd I2P 63 m c4.24; 4.24; 13.67
90; 90; 120
212.829Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York
Crystal Structures, 1963, 1, 239-444
9009139 CIFCd Cl H OP 63 m c3.66; 3.66; 10.27
90; 90; 120
119.142Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York
Crystal Structures, 1963, 1, 239-444
9009140 CIFI2 PbP 63 m c4.557; 4.557; 13.958
90; 90; 120
251.022Wyckoff, R. W. G.
Second edition. Interscience Publishers, New York, New York
Crystal Structures, 1963, 1, 239-444
9009239 CIFNi SP 63 m c3.4456; 3.4456; 5.405
90; 90; 120
55.572Trahan, 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 CIFAl8 Be Mg3 O16P 63 m c5.6867; 5.6867; 18.337
90; 90; 120
513.546Nuber, 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 CIFAl K O4 SiP 63 m c5.3; 5.3; 8.65
90; 90; 120
210.426Kawahara, 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 CIFHg K6 S4P 63 m c9.98; 9.98; 7.64
90; 90; 120
658.999Sommer, H.; Hoppe, R.; Jansen, M.
Das erste thiomercurat(II) mit inselstruktur: K6(HgS4)
Die Naturwissenschaften, 1976, 63, 194-195
9009951 CIFC5 Ba0.318 Ca0.834 Ce0.222 La0.114 Na2.184 Nd0.048 O15 Pr0.018 Sr1.899 Y0.03P 63 m c10.5313; 10.5313; 6.4829
90; 90; 120
622.679Belovitskaya 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 CIFC5 Ba0.378 Ca1.131 Ce0.018 La0.051 Na1.86 O15 Sr2.151 Y0.018P 63 m c10.5263; 10.5263; 6.5392
90; 90; 120
627.49Belovitskaya 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 CIFAl10 H2 O16P 63 m c5.575; 5.575; 8.761
90; 90; 120
235.816Yamaguchi, 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 CIFC SiP 63 m c3.081; 3.081; 15.1248
90; 90; 120
124.338Capitani, 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 CIFFe0.25 Mn0.25 S Zn0.5P 63 m c3.881; 3.881; 6.315
90; 90; 120
82.374Mloszewski, M. J.; Saha, A. K.; Nuffield, E. W.
Manganoan ferroan wurtzite from Llallagua, Bolivia (II)
The Canadian Mineralogist, 1957, 6, 136-139
9010609 CIFO8 Si Sn6P 63 m c7.3742; 7.3742; 11.9598
90; 90; 120
563.228Locock, 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 CIFCu6 Ge S8 WP 63 m c7.5238; 7.5238; 12.39
90; 90; 120
607.402Putz, 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 CIFF6 K2 SiP 63 m c5.6461; 5.6461; 9.2322
90; 90; 120
254.878Gramaccioli, 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 CIFFe4.93 H O8P 63 m c5.928; 5.928; 9.126
90; 90; 120
277.733Michel, 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 CIFFe4.87 H O8P 63 m c5.953; 5.953; 9.096
90; 90; 120
279.16Michel, 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 CIFFe4.75 H O8P 63 m c5.958; 5.958; 8.965
90; 90; 120
275.602Michel, 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 CIFAl NP 63 m c3.11; 3.11; 4.98
90; 90; 120
41.714Xu, Y. N.; Ching, W. Y.
Electronic, optical, and structural properties of some wurtzite crystals
Physical Review B, 1993, 48, 4335-4351
9011658 CIFGa NP 63 m c3.19; 3.19; 5.189
90; 90; 120
45.729Xu, Y. N.; Ching, W. Y.
Electronic, optical, and structural properties of some wurtzite crystals
Physical Review B, 1993, 48, 4335-4351
9011659 CIFBe OP 63 m c2.698; 2.698; 4.38
90; 90; 120
27.611Xu, Y. N.; Ching, W. Y.
Electronic, optical, and structural properties of some wurtzite crystals
Physical Review B, 1993, 48, 4335-4351
9011660 CIFB NP 63 m c2.536; 2.536; 4.199
90; 90; 120
23.387Xu, Y. N.; Ching, W. Y.
Electronic, optical, and structural properties of some wurtzite crystals
Physical Review B, 1993, 48, 4335-4351
9011661 CIFC SiP 63 m c3.076; 3.076; 5.048
90; 90; 120
41.364Xu, 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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