Crystallography Open Database

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1566191 CIFAl18 Be18 Cs6.45 Li9 Na1.2 O162 Si54R -3 c :H15.948; 15.948; 27.81
90; 90; 120
6126Ende, Martin; Gatta, G. Diego; Lotti, Paolo; Grandtner, Alexander; Miletich, Ronald
Cs(Be2Li)Al2Si6O18, a cesium-stuffed host-guest structure, and its structure-property variations with temperature and pressure
Journal of Solid State Chemistry, 2021, 293, 121841
1566192 CIFAl18 Be18 Cs6.57 Li9 Na1.22 O162 Si54R -3 c :H15.943; 15.943; 27.81
90; 90; 120
6122Ende, Martin; Gatta, G. Diego; Lotti, Paolo; Grandtner, Alexander; Miletich, Ronald
Cs(Be2Li)Al2Si6O18, a cesium-stuffed host-guest structure, and its structure-property variations with temperature and pressure
Journal of Solid State Chemistry, 2021, 293, 121841
1566193 CIFAl18 Be18 Cs6.56 Li9 Na1.12 O162 Si54R -3 c :H15.954; 15.954; 27.83
90; 90; 120
6135Ende, Martin; Gatta, G. Diego; Lotti, Paolo; Grandtner, Alexander; Miletich, Ronald
Cs(Be2Li)Al2Si6O18, a cesium-stuffed host-guest structure, and its structure-property variations with temperature and pressure
Journal of Solid State Chemistry, 2021, 293, 121841
1566194 CIFAl18 Be18 Cs6.6 Li9 Na1.15 O162 Si54R -3 c :H15.95; 15.95; 27.82
90; 90; 120
6129Ende, Martin; Gatta, G. Diego; Lotti, Paolo; Grandtner, Alexander; Miletich, Ronald
Cs(Be2Li)Al2Si6O18, a cesium-stuffed host-guest structure, and its structure-property variations with temperature and pressure
Journal of Solid State Chemistry, 2021, 293, 121841
1567488 CIFCa O3 TiP b n m5.3789; 5.4361; 7.6388
90; 90; 90
223.36Ali, R.; Yashima, M.
Space group and crystal structure of the perovskite CaTiO3 from 296 to 1720 K : ortho phase at 296 K
Journal of Solid State Chemistry, 2005, 178, 2867-2872
1567489 CIFCa O3 TiI 4/m c m5.4984; 5.4984; 7.7828
90; 90; 90
235.29Ali, R.; Yashima, M.
Space group and crystal structure of the perovskite CaTiO3 from 296 to 1720 K : tetragonal phase at 1598 K
Journal of Solid State Chemistry, 2005, 178, 2867-2872
1567490 CIFCa O3 TiP m -3 m3.8967; 3.8967; 3.8967
90; 90; 90
59.169Ali, R.; Yashima, M.
Space group and crystal structure of the perovskite CaTiO3 from 296 to 1720 K : tetragonal phase at 1720 K
Journal of Solid State Chemistry, 2005, 178, 2867-2872
1569839 CIFBi Na5 O14 P4P -19.276; 9.806; 7.272
77.73; 109.21; 97.92
608.7Boughzala, H. Jouini, T.
Preparation et structure cristalline d'un nouveau bis-diphosphate de bismuth et de sodium Na5 Bi (P2 O7)2
Journal of Solid State Chemistry, 1999, 143, 104
1571588 CIFH18 Na2 O50 Si20F d d 210.08; 79.383; 10.604
90; 90; 90
8485.1Marler, B.; Grosskreuz, I.; Gies, H.
The crystal structure of synthetic kenyaite, Na2Si20O40(OH)2*8H2O
Journal of Solid State Chemistry, 2021, 1-12
1573926 CIFBa Li N0.25P 42/n m c :27.98; 7.98; 14.263
90; 90; 90
908.3Smetana, Volodymyr; Babizhetskyy, Volodymyr; Vajenine, Grigori V.; Simon, Arndt
Synthesis and crystal structure of LiBa2N and identification of LiBa3N
Journal of Solid State Chemistry, 2007, 180, 1889-1893
2000009 CIFC3 H14 F2 Ga3 N2 O13 P3P b c a10.154; 18.393; 15.773
90; 90; 90
2945.8Loiseau, Thierry; Retoux, Richard; Lacorre, Philippe; Férey, Gérard
Oxyfluorinated Microporous Compounds
Journal of Solid State Chemistry, 1994, 111, 427-436
2000075 CIFC8 H36 N6 O20 P6P -18.709; 9.729; 9.145
99.11; 110.7; 67.19
667.944Gharbi, A.; Jouini, A.; Durif, A.
Structural, DSC, and IR Studies on a New Organic-Cation Cyclohexaphosphate: [NH3-(CH2)2-NH2-(CH2)2-NH3]2P6O18 · 2H2O
Journal of Solid State Chemistry, 1995, 114, 42-51
2000103 CIFC6 H34 Cu2 N6 O17 P4C 1 2/c 118.808; 9.631; 14.019
90; 109.63; 90
2391.81Gharbi, A.; Jouini, A.; Averbuch-Pouchot, M. T.; Durif, A.
Ethylenediammonium bis[Copper(II) Monohydrogendiphosphate Ethylenediamine] Trihydrate
Journal of Solid State Chemistry, 1994, 111, 330-337
2000113 CIFC16 H86 Cd4 Mo12 N4 O72 P8P 1 21/c 114.503; 12.267; 22.202
90; 100.867; 90
3879.09Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.
Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters
Journal of Solid State Chemistry, 1999, 145, 291-301
2000114 CIFC16 H90 Cd2 Mo12 N4 O72 P8P 1 n 115.123; 12.305; 19.264
90; 98.62; 90
3544.32Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.
Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters
Journal of Solid State Chemistry, 1999, 145, 291-301
2000115 CIFC24 H98.6 Cd3 Mo12 N6 O73.3 P8P -111.82; 13.248; 14.794
68.593; 82.067; 87.372
2136.13Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.
Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters
Journal of Solid State Chemistry, 1999, 145, 291-301
2000116 CIFC8 H58 Mo12 N2 O74 P8 Zn3P -111.535; 14.344; 14.5
67.772; 71.517; 76.728
2089.8Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.
Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters
Journal of Solid State Chemistry, 1999, 145, 291-301
2000122 CIFC6 D4 I2P b c a17; 7.323; 6.168
90; 90; 90
767.86Alcobé, Xavier; Estop, Eugènia; Aliev, Abil E.; Harris, Kenneth D. M.; Rodríguez-Carvajal, Juan; Rius, Jordi
Temperature-Dependent Structural Properties of p-Diiodobenzene: Neutron Diffraction and High-Resolution Solid State 13C NMR Investigations
Journal of Solid State Chemistry, 1994, 110, 20-27
2000123 CIFC6 D4 I2P c c n17.092; 7.461; 6.154
90; 90; 90
784.779Alcobé, Xavier; Estop, Eugènia; Aliev, Abil E.; Harris, Kenneth D. M.; Rodríguez-Carvajal, Juan; Rius, Jordi
Temperature-Dependent Structural Properties of p-Diiodobenzene: Neutron Diffraction and High-Resolution Solid State 13C NMR Investigations
Journal of Solid State Chemistry, 1994, 110, 20-27
2002433 CIFMg O6 Ta2P 42/m n m4.7189; 4.7189; 9.2003
90; 90; 90
204.9Halle, G; Mueller-Buschbaum, Hk
Untersuchungen an Zn(1-x) M(x) Ta2 O6 (M = Mg und Ni) mit einer Verfeinerung der Kristallstruktur von Mg Ta2 O6
Journal of Solid State Chemistry, 1988, 142, 263-268
3000125 CIFBa O16 Ra3 S4P n m a9.06956; 5.51771; 7.27476
90; 90; 90
364.052Matyskin, Artem V.; Ylmen, Rikard; Lagerkvist, Petra; Ramebäck, Henrik; Ekberg, Christian
Crystal structure of radium sulfate: An X-ray powder diffraction and density functional theory study
Journal of Solid State Chemistry, 2017, 253, 15-20
3000166 CIFAl4 La Mg2 Ni5R -3 m :H4.83198; 4.83198; 24.15069
90; 90; 120
488.327Hassen Jaafar; Luc Aymard; Walid Dachraoui; Arnaud Demortiere; Mohieddine Abdellaoui
Preparation and characterization of mechanically alloyed AB3-type based material LaMg2Ni5Al4 and its solid-gaz hydrogen storage reaction
Journal of Solid State Chemistry, 2018, 260, 73-79
5910075 CIFC10 H16 OP 21 21 218.9277; 27.0359; 7.3814
90; 90; 90
1781.64M.Brunelli; A.N.Fitch; A.J.Mora
J.Solid State Chem., 2002, 163, 253
6000027 CIFB2 Ga2 O7 SrC m c m11.726; 8.3745; 5.7062
90; 90; 90
560.35Park, H.; Barbier, J.
Crystal structures of new gallo-borates MGa2B2O7, m = Sr, Ba
Journal of Solid State Chemistry, 2000, 154, 598-602
6000028 CIFB2 Ba Ga2 O7C m c m11.7434; 8.7076; 5.8038
90; 90; 90
593.48Park, H.; Barbier, J.
Crystal structures of new gallo-borates MGa2B2O7, m = Sr, Ba
Journal of Solid State Chemistry, 2000, 154, 598-602
6000031 CIFAl Ca2 Nb O6P 1 21/n 15.378; 5.4154; 7.6248
90; 89.968; 90
222.06Vanderah, T. A.; Febo, W.; Chan, J. Y.; Roth, R. S.; Loezos, J. M.; Rotter, L. D.; Geyer, R. G.; Minor, D. B.
Phase equilibria and dielectric behavior in the CaO : Al2O3 : Nb2O5 system
Journal of Solid State Chemistry, 2000, 155, 78-85
6000032 CIFC3 H12 O19 P4 V2I m m m16.821; 9.379; 7.4568
90; 90; 90
1176.4Riou, D.; Serre, C.; Provost, J.; Ferey, G.
Hybrid open frameworks. Hydrothermal synthesis, structure determinations, and magnetic behavior of ((VO)-O-IV)(2)(H2O){O3P-(CH2)(3)-PO3}.2H(2)O: a new vanado-alkyldiphosphonate closely related to VO(HPO4).0.5H(2)O
Journal of Solid State Chemistry, 2000, 155, 238-242
6000070 CIFBa Co0.29 Mn0.72 O3P 63/m m c5.7676; 5.7676; 49.58
90; 90; 120
1428.33Cherepanov, V. A.; Filonova, E. A.; Voronin, V. I.; Berger, I. F.
Phase equilibria in the LaCoO3-LaMnO3-BaCoOz-BaMnO3 system
Journal of Solid State Chemistry, 2000, 153, 205-211
6000071 CIFCa3.1 Cu0.9 O6 RuC 1 2/c 18.9978; 9.2581; 6.4742
90; 91.629; 90
539.1Moore, C. A.; Cussen, E. J.; Battle, P. D.
Synthesis, structural chemistry, and magnetic properties of Ca3.1Cu0.9RuO6
Journal of Solid State Chemistry, 2000, 153, 254-262
6000087 CIFBi2 Nd4 O9C 1 2/m 16.7037; 3.9062; 3.9542
90; 125.258; 90
84.55Lan, Y. C.; Chen, X. L.; Li, J. Q.
Structure of Bi2Nd4O9 monoclinic phase
Journal of Solid State Chemistry, 2000, 153, 30-33
6000088 CIFBi O6 P Zn2P n m a11.897; 5.277; 7.819
90; 90; 90
490.88Ketatni, E.; Mernari, B.; Abraham, F.; Mentre, O.
Crystal structure of BiZn2PO6. Filiation between related compounds
Journal of Solid State Chemistry, 2000, 153, 48-54
6000105 CIFC Fe2 O9 Sr4I 4/m m m3.8891; 3.8891; 27.9818
90; 90; 90
423.22Yamaura, K.; Huang, Q.; Lynn, J. W.; Erwin, R. W.; Cava, R. J.
Synthesis, crystal structure, and magnetic order of the layered iron oxycarbonate Sr4Fe2O6CO3
Journal of Solid State Chemistry, 2000, 152, 374-380
6000144 CIFCu5.59 Ho2 P4.5R -3 m3.976; 3.976; 40.554
90; 90; 120
555.21Mozharivskyj, Y.; Kuz'ma, Y. B.
Ternary phosphide Ho2Cu6-xP5-y, its crystal structure, and REm+n(Cu2P3)(m)(Cu4P2)(n) relationship with other rhombohedral rare-earth copper phosphides
Journal of Solid State Chemistry, 2000, 151, 150-156
6000148 CIFBa1.13 O21 V8C 1 2/m 115.144; 3.596; 14.972
90; 90.08; 90
815.34Oka, Y.; Yao, T.; Yamamoto, N.
Hydrothermal synthesis and crystal structure of a new barium vanadium bronze Ba1+xV8O21 with a tunnel structure
Journal of Solid State Chemistry, 2000, 150, 330-335
6000149 CIFB6 Na3 O13 VP 21 21 217.723; 10.155; 12.505
90; 90; 90
980.73Touboul, M.; Penin, N.; Nowogrocki, G.
Synthesis and crystal structure of the first fully characterized vanadoborate Na-3[B6O9(VO4)]
Journal of Solid State Chemistry, 2000, 150, 342-346
6000154 CIFH10 O19 U3 V2C m c m17.978; 13.561; 7.163
90; 90; 90
1746.34Saadi, M.; Dion, C.; Abraham, F.
Synthesis and crystal structure of the pentahydrated uranyl orthovanadate (UO2)(3)(VO4)(2) 5H(2)O, precursor for the new (UO2)(3)(VO4)(2) uranyl-vanadate
Journal of Solid State Chemistry, 2000, 150, 72-80
6000160 CIFH3 O8 P Rb2 SP 1 21/n 17.448; 7.552; 7.632
90; 100.47; 90
422.13Stiewe, A.; Sonntag, R.; Troyanov, S. I.; Hansen, T.; Kemnitz, E.
Synthesis and structure determination of Rb-2(HSO4)(H2PO4) and Rb-4(HSO4)(3)(H2PO4) by X-ray single crystal and neutron powder diffraction
Journal of Solid State Chemistry, 2000, 149, 9-15
6000161 CIFH3 O8 P Rb2 SP 1 21/c 111.555; 7.536; 9.593
90; 91.56; 90
835.03Stiewe, A.; Sonntag, R.; Troyanov, S. I.; Hansen, T.; Kemnitz, E.
Synthesis and structure determination of Rb-2(HSO4)(H2PO4) and Rb-4(HSO4)(3)(H2PO4) by X-ray single crystal and neutron powder diffraction
Journal of Solid State Chemistry, 2000, 149, 9-15
6000162 CIFH5 O16 P Rb4 S3P 21 21 27.612; 14.795; 7.446
90; 90; 90
838.57Stiewe, A.; Sonntag, R.; Troyanov, S. I.; Hansen, T.; Kemnitz, E.
Synthesis and structure determination of Rb-2(HSO4)(H2PO4) and Rb-4(HSO4)(3)(H2PO4) by X-ray single crystal and neutron powder diffraction
Journal of Solid State Chemistry, 2000, 149, 9-15
6000163 CIFO24 Re4 Sr11I 41/a11.6779; 11.6779; 16.1488
90; 90; 90
2202.27Bramnik, K. G.; Miehe, G.; Ehrenberg, H.; Fuess, H.; Abakumov, A. M.; Shpanchenko, R. V.; Pomjakushin, V. Y.; Balagurov, A. M.
Preparation, structure, and magnetic studies of a new Sr11Re4O24 double oxide
Journal of Solid State Chemistry, 2000, 149, 49-55
6000164 CIFBa4 O10 Ru3C m c a5.7762; 13.271; 13.083
90; 90; 90
1002.89Carim, A. H.; Dera, P.; Finger, L. W.; Mysen, B.; Prewitt, C. T.; Schlom, D. G.
Crystal structure and compressibility of Ba4Ru3O10
Journal of Solid State Chemistry, 2000, 149, 137-142
6000165 CIFH2 K N3 O11 ZrP 1 21/n 116.569; 5.791; 9.813
90; 90.17; 90
941.56Benard-Rocherulle, P.; Louer, D.
Ab initio structure determination of new mixed zirconium hydroxide nitrates ZrM(OH)(2)(NO3)(3) (M = K, Rb) from X-ray powder diffraction data
Journal of Solid State Chemistry, 2000, 149, 167-175
6000166 CIFH2 N3 O11 Rb ZrP b c n10.126; 16.492; 5.855
90; 90; 90
977.77Benard-Rocherulle, P.; Louer, D.
Ab initio structure determination of new mixed zirconium hydroxide nitrates ZrM(OH)(2)(NO3)(3) (M = K, Rb) from X-ray powder diffraction data
Journal of Solid State Chemistry, 2000, 149, 167-175
6000167 CIFB4 H11.2 O12.6 Rb2P b c n11.276; 13.097; 16.751
90; 90; 90
2473.82Touboul, M.; Penin, N.; Nowogrocki, G.
Crystal structure and thermal behavior of Rb-2[B4O5(OH)(4)] 3.6H(2)O
Journal of Solid State Chemistry, 2000, 149, 197-202
6000168 CIFB4 Cs2 H10 O12P 1 21/c 18.424; 11.378; 13.16
90; 92.06; 90
1260.55Touboul, M.; Penin, N.; Nowogrocki, G.
Crystal structure and thermal behavior of Rb-2[B4O5(OH)(4)] 3.6H(2)O
Journal of Solid State Chemistry, 2000, 149, 197-202
6000169 CIFHg20 Rb3P m -3 n10.737; 10.737; 10.737
90; 90; 90
1237.7Todorov, E.; Sevov, S. C.
Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)
Journal of Solid State Chemistry, 2000, 149, 419-427
6000170 CIFCs3 Hg20P m -3 n10.913; 10.913; 10.913
90; 90; 90
1299.7Todorov, E.; Sevov, S. C.
Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)
Journal of Solid State Chemistry, 2000, 149, 419-427
6000171 CIFHg11 K3I m m m5.122; 10.063; 14.782
90; 90; 90
761.9Todorov, E.; Sevov, S. C.
Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)
Journal of Solid State Chemistry, 2000, 149, 419-427
6000172 CIFHg31 K7P 6/m m m10.85; 10.85; 10.21
90; 90; 120
1040.9Todorov, E.; Sevov, S. C.
Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)
Journal of Solid State Chemistry, 2000, 149, 419-427
6000173 CIFHg31 Rb7P 6/m m m11; 11; 10.377
90; 90; 120
1087.4Todorov, E.; Sevov, S. C.
Synthesis and structure of the alkali-metal amalgams A(3)Hg(20) (A = Rb, Cs), K3Hg11, Cs5Hg19, and A(7)Hg(31) (A = K, Rb)
Journal of Solid State Chemistry, 2000, 149, 419-427

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