Crystallography Open Database

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Searching space group like 'R 3 m :R'

COD ID: 1010310
CIF file Formula: - C N Na O -
Comments: Bassiere, M Sur la structure de l'isocyanate de sodium. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 206 (1938) 1309-1311
Space group: R 3 m :R
Cell volume: 55.7
Cell parameters: 5.44; 5.44; 5.44; 38.37; 38.37; 38.37;  

COD ID: 1010596
CIF file Formula: - Br K O3 -
Comments: Zachariasen, W H Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen ABO~3~ Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse 1928 (1928) 1-165
Space group: R 3 m :R
Cell volume: 84.8
Cell parameters: 4.403; 4.403; 4.403; 86; 86; 86;  

COD ID: 1011038
CIF file Formula: - Ni S -
Comments: Alsen, N Roentgenographische Untersuchungen der Kristallstrukturen von Magnetkies, Breithauptit, Pentlandit, Millerit und verwandten Verbindungen Geologiska Foereningens i Stockholm Foerhandlingar 47 (1925) 19-73
Space group: R 3 m :R
Cell volume: 84
Cell parameters: 5.64; 5.64; 5.64; 116.6; 116.6; 116.6;  

COD ID: 1011272
CIF file Formula: - Al3 H7 O14 P2 Sr -
Comments: Gossner, B Ueber Sulfate und Phosphate mit aehnlichem Kristallgitter Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 96 (1937) 488-492
Space group: R 3 m :R
Cell volume: 231.7
Cell parameters: 6.82; 6.82; 6.82; 61.47; 61.47; 61.47;  

COD ID: 1100049
CIF file Formula: - Al8 Cr5 -
Comments: A. J. Bradley; S. S. Lu The Crystal Structures of Cr~2~Al and Cr~2~Al~8~ Z. Kristallogr. A 96(1) (1937) 20-37
Space group: R 3 m :R
Cell volume: 370.6
Cell parameters: 7.805; 7.805; 7.805; 109.127; 109.127; 109.127;  

COD ID: 1100050
CIF file Formula: - Al16 Cr9.5 -
Comments: Brandon, J. K.; Pearson, W. B.; Riley, P. W.; Chien, C.; Stokhuyzen, R. γ-Brasses with R cells Acta Crystallographica Section B 33(4) (1977) 1088-1095
Space group: R 3 m :R
Cell volume: 371.42
Cell parameters: 7.811; 7.811; 7.811; 109.13; 109.13; 109.13;  

COD ID: 1521252
CIF file Formula: - Fe0.5 Nb0.5 O3 Pb -
Comments: Ivanov, S.A.; Tellgren, R.; Thomas, N.W.; Rundlof, H.; Ananta, S. Investigation of the structure of the relaxor ferroelectric Pb (Fe1/2 Nb1/2) O3 by neutron diffraction Journal of Physics: Condensed Matter 12 (2000) 2393-2400
Space group: R 3 m :R
Cell volume: 64.592
Cell parameters: 4.0123; 4.0123; 4.0123; 89.98; 89.98; 89.98;  

COD ID: 1525596
CIF file Formula: - O6 Pb2 Sc Ta -
Comments: Baba-Kishi, K.Z.; Knight, K.; Woodward, P.M. The crystal structures of Pb2 Sc Ta O6 and Pb2 Sc Nb O6 in the paraelectric and ferroelectric states Ferroelectrics 261 (2001) 21-26
Space group: R 3 m :R
Cell volume: 541.653
Cell parameters: 8.15157; 8.15157; 8.15157; 89.881; 89.881; 89.881;  

COD ID: 1529841
CIF file Formula: - C H6 B F4 N3 -
Comments: de Kozak, A.; Grottel, M.; Pajak, Z.; Koziol, A.E. An X-ray and NMR cross-relaxation study of structure and ion motions in C (N H2)3 B F4 Journal of Physics C 20 (1987) 5433-5447
Space group: R 3 m :R
Cell volume: 145.946
Cell parameters: 5.265; 5.265; 5.265; 90.09; 90.09; 90.09;  

COD ID: 1531970
CIF file Formula: - Cl K O3 -
Comments: Pistorius, C.W.F.T. Lattice constants of the high-pressure phase K Cl O3 (II) Journal of Chemical Physics 56 (1972) 6263-6264
Space group: R 3 m :R
Cell volume: 77.241
Cell parameters: 4.273; 4.273; 4.273; 85.2; 85.2; 85.2;  

COD ID: 1532104
CIF file Formula: - Ag4 D11.4 Ge7 O21.7 -
Comments: Roberts, M.A.; Fitch, A.N. The crystal structures of Ag4 Ge7 O16 * 6(D2 O) and Na3 (N D4) Ge7 O16 * (D2 O) refined from high resolution synchrotron radiation and neutron powder diffraction data Journal of Physics and Chemistry of Solids 52 (1991) 1209-1218
Space group: R 3 m :R
Cell volume: 467.352
Cell parameters: 7.762; 7.762; 7.762; 88.81; 88.81; 88.81;  

COD ID: 1532105
CIF file Formula: - D15.68 Ge7 N0.96 Na3 O21.92 -
Comments: Roberts, M.A.; Fitch, A.N. The crystal structures of Ag4 Ge7 O16 * 6(D2 O) and Na3 (N D4) Ge7 O16 * (D2 O) refined from high resolution synchrotron radiation and neutron powder diffraction data Journal of Physics and Chemistry of Solids 52 (1991) 1209-1218
Space group: R 3 m :R
Cell volume: 468.597
Cell parameters: 7.769; 7.769; 7.769; 88.77; 88.77; 88.77;  

COD ID: 1535108
CIF file Formula: - Al7.1 B3 Ca0.05 Fe0.41 H3.92 Li1.15 Mg0.12 Mn0.21 Na0.85 O30.92 Si6 -
Comments: Belokoneva, E.L.; Tsirel'son, V.G. Electron density distribution and specific features of chemical bonding in turmaline-elbaite according to accurate X-ray diffraction data Zhurnal Neorganicheskoi Khimii 38 (1993) 1351-1358
Space group: R 3 m :R
Cell volume: 520.938
Cell parameters: 9.477; 9.477; 9.477; 113.9; 113.9; 113.9;  

COD ID: 1537749
CIF file Formula: - N3 Na -
Comments: Bassiere, M. Structure cristalline des azotures. La constitution de l'anion azothydrique Memorial des Services Chimiques de l'Etat 30 (1943) 33-46
Space group: R 3 m :R
Cell volume: 58.48
Cell parameters: 5.499; 5.499; 5.499; 38.72; 38.72; 38.72;  

COD ID: 1538393
CIF file Formula: - O3 Pb Ti0.42 Zr0.58 -
Comments: Michel, C.; Moreau, J.M.; Achenbach, G.D.; Gerson, R.; James, W.J. Atomic structures of two rhombohedral ferroelectric phases in the Pb (Zr Ti) O3 solid solution series Solid State Communications 7 (1969) 865-868
Space group: R 3 m :R
Cell volume: 67.415
Cell parameters: 4.07; 4.07; 4.07; 89.65; 89.65; 89.65;  

COD ID: 1538656
CIF file Formula: - Ni S -
Comments: Lundqvist, D. X-ray studies in the binary system Ni-S Arkiv foer Kemi, Mineralogi och Geologi 24 (1947) 1-12
Space group: R 3 m :R
Cell volume: 83.723
Cell parameters: 5.64; 5.64; 5.64; 116.62; 116.62; 116.62;  

COD ID: 1539089
CIF file Formula: - K N O3 -
Comments: Shinnaka, Y. X-ray study on the disordered structure above the ferroelectric curie point in potassium nitrate Journal of the Physical Society of Japan 17 (1962) 820-828
Space group: R 3 m :R
Cell volume: 82.032
Cell parameters: 4.498; 4.498; 4.498; 73.93; 73.93; 73.93;  

COD ID: 1551317
CIF file Formula: - C7 H14 N O4 Re -
Comments: Jun Harada; Takafumi Shimojo; Hideaki Oyamaguchi; Hiroyuki Hasegawa; Yukihiro Takahashi; Koichiro Satomi; Yasutaka Suzuki; Jun Kawamata; Tamotsu Inabe Directionally tunable and mechanically deformable ferroelectric crystals from rotating polar globular ionic molecules Nature Chemistry 8 (2016) 946-952
Space group: R 3 m :R
Cell volume: 257.26
Cell parameters: 6.36; 6.36; 6.36; 89.912; 89.912; 89.912;  

COD ID: 1560386
CIF file Formula: - O3 Pb Ti0.4 Zr0.6 -
Comments: Amin, A.; Newnham, R. E.; Cross, L. E.; Cox, D. E. Phenomenological and structural study of a low-temperature phase transition in the Pb Zr O3 - Pb Ti O3 system Journal of Solid State Chemistry 37 (1981) 248-255
Space group: R 3 m :R
Cell volume: 67.959
Cell parameters: 4.0809; 4.0809; 4.0809; 89.676; 89.676; 89.676;  

COD ID: 2015348
CIF file

Original IUCr paper

 Formula: - Nb0.61 O3 Pb Zn0.39 -
Comments: Kisi, Erich H.; Forrester, Jennifer S.; Knight, Kevin S. PbZn~1/3~Nb~2/3~O~3~ at 4.2 and 295K Acta Crystallographica Section C 62(6) (2006) i46-i48
Space group: R 3 m :R
Cell volume: 66.9466
Cell parameters: 4.06048; 4.06048; 4.06048; 89.8693; 89.8693; 89.8693;  

COD ID: 2015349
CIF file

Original IUCr paper

 Formula: - Nb0.61 O3 Pb Zn0.39 -
Comments: Kisi, Erich H.; Forrester, Jennifer S.; Knight, Kevin S. PbZn~1/3~Nb~2/3~O~3~ at 4.2 and 295K Acta Crystallographica Section C 62(6) (2006) i46-i48
Space group: R 3 m :R
Cell volume: 67.042
Cell parameters: 4.0624; 4.0624; 4.0624; 89.9226; 89.9226; 89.9226;  

COD ID: 2103181
CIF file

Original IUCr paper

 Formula: - C6 H12 N3 O P -
Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77
Space group: R 3 m :R
Cell volume: 181.512
Cell parameters: 5.8847; 5.8847; 5.8847; 104.09; 104.09; 104.09;  

COD ID: 2103182
CIF file

Original IUCr paper

 Formula: - C6 H12 N3 P S -
Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77
Space group: R 3 m :R
Cell volume: 207.455
Cell parameters: 6.0482; 6.0482; 6.0482; 100.9; 100.9; 100.9;  

COD ID: 2103190
CIF file

Original IUCr paper

 Formula: - C6 H12 N3 P -
Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77
Space group: R 3 m :R
Cell volume: 187.069
Cell parameters: 6.024; 6.024; 6.024; 105.94; 105.94; 105.94;  

COD ID: 2106531
CIF file Formula: - Cs H O3 S -
Comments: Johansson, L.G.; Lindqvist, O.; Vannerberg, N.G. The structure of cesium hydrogensulfite Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2523-2526
Space group: R 3 m :R
Cell volume: 101.013
Cell parameters: 4.6721; 4.6721; 4.6721; 85.31; 85.31; 85.31;  

COD ID: 2310414
CIF file Formula: - C3 Al4 -
Comments: Jeffrey, G.A.; Wu, V.Y. The structures of the aluminum carbonitrides. II Acta Crystallographica (1,1948-23,1967) 20 (1966) 538-547
Space group: R 3 m :R
Cell volume: 79.718
Cell parameters: 8.52; 8.52; 8.52; 22.54; 22.54; 22.54;  

COD ID: 4128704
CIF file Formula: - C6 H12 N O4 Re -
Comments: Harada, Jun; Kawamura, Yuto; Takahashi, Yukihiro; Uemura, Yohei; Hasegawa, Tatsuo; Taniguchi, Hiroki; Maruyama, Koji Plastic/Ferroelectric Crystals with Easily Switchable Polarization: Low-Voltage Operation, Unprecedentedly High Pyroelectric Performance, and Large Piezoelectric Effect in Polycrystalline Forms. Journal of the American Chemical Society 141(23) (2019) 9349-9357
Space group: R 3 m :R
Cell volume: 235.75
Cell parameters: 6.1776; 6.1776; 6.1776; 89.846; 89.846; 89.846;  

COD ID: 4326757
CIF file Formula: - C30 H43 K O6 Si2 -
Comments: David J. Wolstenholme; Paul D. Prince; G. Sean McGrady; Michael J. Landry; Jonathan W. Steed Structure and Bonding of KSiH3 and Its 18-Crown-6 Derivatives: Unusual Ambidentate Behavior of the SiH3- Anion Inorganic Chemistry 50 (2011) 11222-11227
Space group: R 3 m :R
Cell volume: 820.06
Cell parameters: 9.4687; 9.4687; 9.4687; 98.201; 98.201; 98.201;  

COD ID: 6000528
CIF file Formula: - D16 Ge7 N Na3 O22 -
Comments: Roberts, M. A.; Fitch, A. N. The crystal-structures of Ag~4~Ge~7~O~16~·6D~2~O and Na~3~(ND~4~)Ge~7~O~16~·6D~2~O refined from high-resolution synchrotron radiation and neutron powder diffraction data Journal of Physics and Chemistry of Solids 52(10) (1991) 1209-1218
Space group: R 3 m :R
Cell volume: 468.6
Cell parameters: 7.769; 7.769; 7.769; 88.77; 88.77; 88.77;  

COD ID: 7003171
CIF file Formula: - C30 H41 K O6 Si -
Comments: Prince, Paul D.; Bearpark, Michael J.; McGrady, G. Sean; Steed, Jonathan W. Hypervalent hydridosilicates: synthesis, structure and hydride bridging Dalton Transactions (issue 2) (2008) 271-282
Space group: R 3 m :R
Cell volume: 813.8
Cell parameters: 9.4377; 9.4377; 9.4377; 97.956; 97.956; 97.956;  

COD ID: 8104192
CIF file Formula: - Ga Mo4 Se8 -
Comments: Francois, M.; Yvon, K.; Alexandrov, O.V.; Gougeon, P.; Ben Yaich-Aerrache, H.; Potel, M.; Sergent, M. Structural phase transition in Ga Mo4 Se8 and Al Mo4 S8 by X-ray powder diffraction Zeitschrift fuer Kristallographie (149,1979-) 200 (1992) 47-55
Space group: R 3 m :R
Cell volume: 262.212
Cell parameters: 7.1537; 7.1537; 7.1537; 60.572; 60.572; 60.572;  

COD ID: 8104195
CIF file Formula: - Al Mo4 S8 -
Comments: Francois, M.; Ben Yaich-Aerrache, H.; Alexandrov, O.V.; Yvon, K.; Potel, M.; Gougeon, P.; Sergent, M. Structural phase transition in Ga Mo4 Se8 and Al Mo4S 8 by X-ray powder diffraction Zeitschrift fuer Kristallographie (149,1979-) 200 (1992) 47-55
Space group: R 3 m :R
Cell volume: 229.2
Cell parameters: 6.85; 6.85; 6.85; 60.374; 60.374; 60.374;  

COD ID: 9000296
CIF file Formula: - F Na3 O4 S -
Comments: Pabst, A.; Sharp, W. N. Kogarkoite, a new natural phase in the system Na2SO4 - NaF - NaCl American Mineralogist 58 (1973) 116-127
Space group: R 3 m :R
Cell volume: 113.63
Cell parameters: 4.846; 4.846; 4.846; 91.8; 91.8; 91.8;  

COD ID: 9011055
CIF file Formula: - Cu1.25 Fe0.25 S -
Comments: Morimoto, N. Structures of two polymorphic forms of Cu5FeS4 Sample: metastable, twin process Acta Crystallographica 17 (1964) 351-360
Space group: R 3 m :R
Cell volume: 81.736
Cell parameters: 6.7; 6.7; 6.7; 33.53; 33.53; 33.53;  

COD ID: 9011432
CIF file Formula: - As S3 Tl3 -
Comments: Gostojic, M. Die kristallstruktur von synthetischem ellisit, Tl3AsS3 Note: anisob's corrected to match reported Biso's Zeitschrift fur Kristallographie 151 (1980) 249-254
Space group: R 3 m :R
Cell volume: 184.847
Cell parameters: 5.9967; 5.9967; 5.9967; 105.87; 105.87; 105.87;  

COD ID: 9012535
CIF file Formula: - Cu7 Hg6 -
Comments: Lindahl, T.; Westman, S. The structure of the rhombohedral gamma brass like phase in the copper-mercury system Locality: synthetic Acta Chemica Scandinavica 23 (1969) 1181-1190
Space group: R 3 m :R
Cell volume: 831.151
Cell parameters: 9.4024; 9.4024; 9.4024; 90.425; 90.425; 90.425;  

COD ID: 9014074
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 180 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.206
Cell parameters: 4.0043; 4.0043; 4.0043; 89.855; 89.855; 89.855;  

COD ID: 9014179
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 150 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.273
Cell parameters: 4.0057; 4.0057; 4.0057; 89.846; 89.846; 89.846;  

COD ID: 9014230
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 20 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.172
Cell parameters: 4.0036; 4.0036; 4.0036; 89.84; 89.84; 89.84;  

COD ID: 9014743
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 15 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.172
Cell parameters: 4.0036; 4.0036; 4.0036; 89.839; 89.839; 89.839;  

COD ID: 9014756
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 170 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.196
Cell parameters: 4.0041; 4.0041; 4.0041; 89.852; 89.852; 89.852;  

COD ID: 9015236
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 130 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.184
Cell parameters: 4.00385; 4.00385; 4.00385; 89.843; 89.843; 89.843;  

COD ID: 9015616
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 40 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.167
Cell parameters: 4.0035; 4.0035; 4.0035; 89.843; 89.843; 89.843;  

COD ID: 9016152
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 70 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.201
Cell parameters: 4.0042; 4.0042; 4.0042; 89.837; 89.837; 89.837;  

COD ID: 9016624
CIF file Formula: - Ba O3 Ti -
Comments: Kwei, G. H.; Lawson, A. C.; Billinge, S. J. L.; Cheong, S. W. Structures of the ferroelectric phases of barium titanate Note: T = 100 K Journal of Physical Chemistry 97 (1993) 2368-2377
Space group: R 3 m :R
Cell volume: 64.201
Cell parameters: 4.0042; 4.0042; 4.0042; 89.836; 89.836; 89.836;  


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