Crystallography Open Database
Search results
Result: there are 10718 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format
We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.
Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2003103 | CIF Paper | C11 H24 N2 O4 | P 1 21 1 | 5.2528; 23.9809; 5.42 90; 110.42; 90 | 639.84 | Dalhus, Bjørn; Görbitz, Carl Henrik Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series Acta Crystallographica Section B, 1999, 55, 424-431 |
| 2003104 | CIF Paper | C12 H26 N2 O4 | P 1 | 5.1933; 5.4064; 13.6968 91.516; 98.603; 110.376 | 355.16 | Dalhus, Bjørn; Görbitz, Carl Henrik Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series Acta Crystallographica Section B, 1999, 55, 424-431 |
| 2003105 | CIF Paper | Bi14 O24 W | I 4/m | 8.71083; 8.71083; 17.32202 90; 90; 90 | 1314.37 | Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S. Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data Acta Crystallographica Section B, 1999, 55, 306-312 |
| 2003106 | CIF Paper | Bi14 Mo O24 | I 4/m | 8.70839; 8.70839; 17.31634 90; 90; 90 | 1313.2 | Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S. Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data Acta Crystallographica Section B, 1999, 55, 306-312 |
| 2003108 | CIF Paper | Cl4 Cs2 Hg | P n m a | 9.8136; 7.6018; 13.4201 90; 90; 90 | 1001.15 | Bagautdinov, B.; Luedecke, J.; Schneider, M.; van Smaalen, S. Disorder in the Crystal Structure of Cs~2~HgCl~4~ Studied by the Maximum Entropy Method Acta Crystallographica Section B, 1998, 54, 626-634 |
| 2003109 | CIF Paper | C10 H15 Li | R 3 m :H | 14.7711; 14.7711; 3.82206 90; 90; 120 | 722.19 | Robert E. Dinnebier Disorder determined by high-resolution powder diffraction: structure of pentamethylcyclopentadienyllithium Acta Crystallographica Section B, 1999, 55, 35-44 |
| 2003110 | CIF Paper | C15 H28 N4 O4 | P 1 21/c 1 | 5.8907; 26.071; 11.8868 90; 106.118; 90 | 1753.8 | Marc Hostettler; Henrik Birkedal; Manual Gardon; Gervais Chapuis; Dieter Schwarzenbach; Michel Bonin Phase-transition-induced twinning in the 1:1 adduct of hexamethylenetetramine and azelaic acid Acta Crystallographica Section B, 1999, 55, 448-458 |
| 2003111 | CIF Paper | Al2 F2 O4 Si | P b n m | 4.6511; 8.802; 8.402 90; 90; 90 | 343.97 | Ivanov, Yu.V.; Belokoneva, E.L.; Protas, J.; Hansen, N.K.; Tsirelson, V.G. Multipole Analysis of the Electron Density in Topaz Using X-ray Diffraction Data Acta Crystallographica Section B, 1998, 54, 774-781 |
| 2003112 | CIF Paper | C H4 N2 O | P -4 21 m | 5.589; 5.589; 4.6947 90; 90; 90 | 146.65 | Zavodnik, Valery; Stash, Adam; Tsirelson, Vladimir; de Vries, Roelof; Feil, Dirk Electron density study of urea using TDS-corrected X-ray diffraction data: quantitative comparison of experimental and theoretical results Acta Crystallographica Section B, 1999, 55, 45-54 |
| 2003113 | CIF Paper | C H8 N O4 P | P 1 21/c 1 | 9.9645; 7.1801; 7.8897 90; 96.243; 90 | 561.13 | Antonia Neels; Helen Stoeckli-Evans; Jochen Neels; Abraham Clearfield; Damodara Poojary <i>Ab Initio</i> Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data Acta Crystallographica Section B, 1998, 54, 478-484 |
| 2003114 | CIF Paper | C2 H10 N O4 P | P 1 21/c 1 | 12.6453; 7.1502; 7.9738 90; 108.875; 90 | 682.19 | Antonia Neels; Helen Stoeckli-Evans; Jochen Neels; Abraham Clearfield; Damodara Poojary <i>Ab Initio</i> Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data Acta Crystallographica Section B, 1998, 54, 478-484 |
| 2003115 | CIF Paper | C3 H12 N O4 P | A 1 n 1 | 6.2475; 29.3825; 4.6305 90; 100.904; 90 | 834.66 | Antonia Neels; Helen Stoeckli-Evans; Jochen Neels; Abraham Clearfield; Damodara Poojary <i>Ab Initio</i> Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data Acta Crystallographica Section B, 1998, 54, 478-484 |
| 2003116 | CIF Paper | C19 Er10 Ru10 | A m m 2 | 3.6097; 18.632; 7.289 90; 90; 90 | 490.23 | Hoffmann, R.-D.; Jeitschko, W. The Carbides Ln~10~Ru~10~C~19~ (Ln = Y, Gd-Lu): Crystal Structure of their Subcells and the Superstructures of Er~10~Ru~10~C~19~ Acta Crystallographica Section B, 1998, 54, 834-850 |
| 2003117 | CIF Paper | C19 Er10 Ru10 | A m m 2 | 3.6097; 18.632; 7.289 90; 90; 90 | 490.23 | Hoffmann, R.-D.; Jeitschko, W. The Carbides Ln~10~Ru~10~C~19~ (Ln = Y, Gd-Lu): Crystal Structure of their Subcells and the Superstructures of Er~10~Ru~10~C~19~ Acta Crystallographica Section B, 1998, 54, 834-850 |
| 2003118 | CIF Paper | C19 Er10 Ru10 | C 1 m 1 | 14.578; 7.2194; 10.004 90; 111.36; 90 | 980.5 | Hoffmann, R.-D.; Jeitschko, W. The Carbides Ln~10~Ru~10~C~19~ (Ln = Y, Gd-Lu): Crystal Structure of their Subcells and the Superstructures of Er~10~Ru~10~C~19~ Acta Crystallographica Section B, 1998, 54, 834-850 |
| 2003119 | CIF Paper | C19 Er10 Ru10 | A m m 2 | 37.264; 7.219; 14.578 90; 90; 90 | 3921.6 | Hoffmann, R.-D.; Jeitschko, W. The Carbides Ln~10~Ru~10~C~19~ (Ln = Y, Gd-Lu): Crystal Structure of their Subcells and the Superstructures of Er~10~Ru~10~C~19~ Acta Crystallographica Section B, 1998, 54, 834-850 |
| 2003120 | CIF Paper | As F6 K | R -3 :H | 7.348; 7.348; 7.274 90; 90; 120 | 340.1 | Peterková, J.; Dusek, M.; Petrícek, V.; Loub, J. Structures of Fluoroarsenates KAsF~6<i>n~</i>(OH)~<i>n~</i>, <i>n</i> = 0, 1, 2: Application of the Heavy-Atom Method for Modulated Structures Acta Crystallographica Section B, 1998, 54, 809-818 |
| 2003121 | CIF Paper | As F5 H K O | P n a b | 9.391; 11.336; 28.173 90; 90; 90 | 2999.2 | Peterková, J.; Dusek, M.; Petrícek, V.; Loub, J. Structures of Fluoroarsenates KAsF~6<i>n~</i>(OH)~<i>n~</i>, <i>n</i> = 0, 1, 2: Application of the Heavy-Atom Method for Modulated Structures Acta Crystallographica Section B, 1998, 54, 809-818 |
| 2003122 | CIF Paper | As F4 H2 K O2 | C 1 2/c 1 | 4.818; 16.001; 6.374 90; 99.36; 90 | 484.8 | Peterková, J.; Dusek, M.; Petrícek, V.; Loub, J. Structures of Fluoroarsenates KAsF~6<i>n~</i>(OH)~<i>n~</i>, <i>n</i> = 0, 1, 2: Application of the Heavy-Atom Method for Modulated Structures Acta Crystallographica Section B, 1998, 54, 809-818 |
| 2003123 | CIF | Al2 Ca H6 O13 Si3 | F 1 d 1 | 18.489; 18.959; 6.519 90; 90.611; 90 | 2284.8 | Kuntzinger, Sandrine; Ghermani, Nour Eddine; Dusausoy, Yves; Lecomte, Claude Distribution and Topology of the Electron Density in an Aluminosilicate Compound From High Resolution X-Ray Diffraction Data : The Case of Scolecite Acta Crystallographica, Section B, 1998, 54, 819-833 |
| 2003124 | CIF HKL Paper | Fe Nd O3 | P n m a | 5.5887; 7.7619; 5.4489 90; 90; 90 | 236.37 | Streltsov, V. A.; Ishizawa, N. Synchrotron X-ray study of the electron density in <i>R</i>FeO~3~ (<i>R</i> = Nd, Dy) Acta Crystallographica Section B, 1999, 55, 1-7 |
| 2003125 | CIF HKL Paper | Dy Fe O3 | P n m a | 5.5957; 7.629; 5.3009 90; 90; 90 | 226.29 | Streltsov, V. A.; Ishizawa, N. Synchrotron X-ray study of the electron density in <i>R</i>FeO~3~ (<i>R</i> = Nd, Dy) Acta Crystallographica Section B, 1999, 55, 1-7 |
| 2003129 | CIF HKL Paper | Al Li O6 Si2 | C 1 2/c 1 | 9.462; 8.392; 5.221 90; 110.18; 90 | 389.12 | Kuntzinger, Sandrine; Ghermani, Nour Eddine Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data Acta Crystallographica Section B, 1999, 55, 273-284 |
| 2003130 | CIF HKL Paper | Al Li O6 Si2 | C 1 2/c 1 | 9.456; 8.386; 5.216 90; 110.13; 90 | 388.35 | Kuntzinger, Sandrine; Ghermani, Nour Eddine Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data Acta Crystallographica Section B, 1999, 55, 273-284 |
| 2003131 | CIF Paper | Nb0.5 O3 Sr Yb0.5 | P 1 21/n 1 | 5.79095; 5.8221; 8.20358 90; 90.1262; 90 | 276.59 | Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~ Acta Crystallographica, Section B, 1999, 55, 348-354 |
| 2003132 | CIF Paper | Nb0.5 O3 Sr Yb0.5 | P 1 21/n 1 | 5.79095; 5.8221; 8.20358 90; 90.1262; 90 | 276.59 | Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~ Acta Crystallographica, Section B, 1999, 55, 348-354 |
| 2003133 | CIF HKL Paper | C5 H5 Cl4 Hg N | P 1 21/n 1 | 9.094; 18.143; 12.902 90; 106.13; 90 | 2045 | Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick Polynuclear chloromercurate(II) systems in their chloropyridinium salts Acta Crystallographica Section B, 1999, 55, 396-409 |
| 2003134 | CIF HKL Paper | C20 H20 Cl14 Hg3 N4 | P 1 21/n 1 | 7.522; 28.046; 9.165 90; 105.78; 90 | 1860.6 | Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick Polynuclear chloromercurate(II) systems in their chloropyridinium salts Acta Crystallographica Section B, 1999, 55, 396-409 |
| 2003135 | CIF Paper | C20 H20 Cl14 Hg3 N4 | P -1 | 9.907; 13.226; 7.282 84.41; 74.81; 87.34 | 916.2 | Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick Polynuclear chloromercurate(II) systems in their chloropyridinium salts Acta Crystallographica Section B, 1999, 55, 396-409 |
| 2003136 | CIF HKL Paper | C5 H5 Cl4 Hg N | P 1 21/c 1 | 7.243; 22.145; 12.32 90; 99.52; 90 | 1948.9 | Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick Polynuclear chloromercurate(II) systems in their chloropyridinium salts Acta Crystallographica Section B, 1999, 55, 396-409 |
| 2003137 | CIF HKL Paper | C10 H10 Cl8 Hg2 N2 | C 1 2/m 1 | 13.447; 7.534; 9.939 90; 97.48; 90 | 998.3 | Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick Polynuclear chloromercurate(II) systems in their chloropyridinium salts Acta Crystallographica Section B, 1999, 55, 396-409 |
| 2003138 | CIF | O3 Pb Zr | P b a m | 5.8779; 11.7846; 8.2042 90; 90; 90 | 568.27 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003139 | CIF | O3 Pb Zr | P b a m | 5.8822; 11.7813; 8.2293 90; 90; 90 | 570.28 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003140 | CIF | O3 Pb Zr | P b a m | 5.8779; 11.7846; 8.2042 90; 90; 90 | 568.27 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003141 | CIF | O3 Pb Zr | P b a m | 5.8775; 11.7835; 8.2088 90; 90; 90 | 568.5 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003142 | CIF | O3 Pb Zr | P b a m | 5.8797; 11.7827; 8.2162 90; 90; 90 | 569.17 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003143 | CIF | O3 Pb Zr | P b a m | 5.8819; 11.782; 8.2294 90; 90; 90 | 570.3 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003144 | CIF | O3 Pb Zr | P b a m | 5.8808; 11.7703; 8.2539 90; 90; 90 | 571.31 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003145 | CIF | O3 Pb Zr | P b a m | 5.8822; 11.7813; 8.2293 90; 90; 90 | 570.28 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003146 | CIF | O3 Pb Zr | P b a m | 5.8775; 11.7835; 8.2088 90; 90; 90 | 568.5 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003147 | CIF | O3 Pb Zr | P b a m | 5.8797; 11.7827; 8.2162 90; 90; 90 | 569.17 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003148 | CIF | O3 Pb Zr | P b a m | 5.8819; 11.782; 8.2294 90; 90; 90 | 570.3 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003149 | CIF | O3 Pb Zr | P b a m | 5.8808; 11.7703; 8.2539 90; 90; 90 | 571.31 | Teslic, S.; Egami, T. Atomic Structure of PbZrO3 Determined by Pulsed Neutron Diffraction Acta Crystallographica, Section B: Structural Science, 1998, 54, 750-765 |
| 2003150 | CIF Paper | Cl4 Co H22 N7 O8 | R -3 m :H | 7.072; 7.072; 27.144 90; 90; 120 | 1175.7 | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ Acta Crystallographica Section B, 1998, 54, 613-625 |
| 2003151 | CIF Paper | Cl4 Co H22 N7 O8 | R -3 :H | 7.025; 7.025; 26.988 90; 90; 120 | 1153.4 | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ Acta Crystallographica Section B, 1998, 54, 613-625 |
| 2003152 | CIF Paper | Cl4 Co Cs H18 N6 O8 | R -3 m :H | 7.239; 7.239; 27.119 90; 90; 120 | 1230.7 | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ Acta Crystallographica Section B, 1998, 54, 613-625 |
| 2003153 | CIF Paper | Cl4 H22 N7 O8 Ru | R -3 m :H | 7.129; 7.129; 27.56 90; 90; 120 | 1213 | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ Acta Crystallographica Section B, 1998, 54, 613-625 |
| 2003154 | CIF Paper | Cl4 H18 K N6 O8 Ru | R -3 m :H | 7.027; 7.027; 27.57 90; 90; 120 | 1179 | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ Acta Crystallographica Section B, 1998, 54, 613-625 |
| 2003155 | CIF Paper | Cl4 H18 K N6 O8 Ru | R -3 m :H | 6.965; 6.965; 27.333 90; 90; 120 | 1148.3 | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ Acta Crystallographica Section B, 1998, 54, 613-625 |
| 2003156 | CIF Paper | Cl4 H18 N6 O8 Rb Ru | R -3 m :H | 7.1392; 7.1392; 27.599 90; 90; 120 | 1218.2 | Figgis, B. N.; Sobolev, A. N.; Reynolds, P. A. Phase Transitions and Structures at 10, 92 and 293 K in Eight Trigonal Double Salts <i>M</i>^I^[<i>M</i>^III^(NH~3~)~6~](ClO~4~)~2~<i>X</i>~2~ Acta Crystallographica Section B, 1998, 54, 613-625 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!