Crystallography Open Database
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Result: there are 195 entries in the selection
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Searching journal of publication like 'Acta Crystallographica Section A'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2310141 | CIF | C7 H13 N O5 | P 21 21 21 | 10.0123; 9.2556; 10.2441 90; 90; 90 | 949.32 | Lübben, Jens; Volkmann, Christian; Grabowsky, Simon; Edwards, Alison; Morgenroth, Wolfgang; Fabbiani, Francesca P. A.; Sheldrick, George M.; Dittrich, Birger On the temperature dependence of H-<i>U</i>~iso~ in the riding hydrogen model Acta Crystallographica Section A, 2014, 70, 309-316 |
| 2310143 | CIF HKL Paper | C13 H15 N O6 | P 1 21 1 | 10.905; 5.2338; 11.439 90; 101.36; 90 | 640.1 | Woińska, Magdalena; Jayatilaka, Dylan; Spackman, Mark A.; Edwards, Alison J.; Dominiak, Paulina M.; Woźniak, Krzysztof; Nishibori, Eiji; Sugimoto, Kunihisa; Grabowsky, Simon Hirshfeld atom refinement for modelling strong hydrogen bonds Acta Crystallographica Section A, 2014, 70, 483-498 |
| 2310144 | CIF HKL Paper | C13 H15 N O6 | P 1 21 1 | 10.905; 5.2338; 11.439 90; 101.36; 90 | 640.1 | Woińska, Magdalena; Jayatilaka, Dylan; Spackman, Mark A.; Edwards, Alison J.; Dominiak, Paulina M.; Woźniak, Krzysztof; Nishibori, Eiji; Sugimoto, Kunihisa; Grabowsky, Simon Hirshfeld atom refinement for modelling strong hydrogen bonds Acta Crystallographica Section A, 2014, 70, 483-498 |
| 2310146 | CIF Paper | C4 H8 N2 O3 | P 1 21/c 1 | 7.9798; 9.5201; 7.7643 90; 106.151; 90 | 566.562 | Dos Santos, Leonardo H. R.; Genoni, Alessandro; Macchi, Piero Unconstrained and X-ray constrained extremely localized molecular orbitals: analysis of the reconstructed electron density Acta Crystallographica Section A, 2014, 70, 532-551 |
| 2310149 | CIF HKL Paper | C60.41 H53.29 I6 N12 O2.44 Zn3 | C 1 2/c 1 | 34.346; 15.114; 32.5502 90; 103.415; 90 | 16436 | Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method Acta Crystallographica Section A, 2015, 71 |
| 2310150 | CIF HKL | C55.61 H47.39 Cl2.1 I6 N12 Zn3 | C 1 2/c 1 | 34.936; 14.9785; 30.825 90; 102.857; 90 | 15726 | Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method Acta Crystallographica Section A, 2015, 71 |
| 2310151 | CIF HKL | C411.01 H417.06 Cl1.65 I47.98 N96 O20.41 Zn23.99 | P 1 21 1 | 34.966; 14.8683; 66.99 90; 104.191; 90 | 33764 | Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method Acta Crystallographica Section A, 2015, 71 |
| 2310152 | CIF HKL | C37.44 H25.44 Cl4.32 I6 N12 Zn3 | C 1 2/c 1 | 34.655; 14.7307; 31.081 90; 101.031; 90 | 15573 | Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method Acta Crystallographica Section A, 2015, 71 |
| 2310190 | CIF | Rh3 U | P m -3 m | 3.988; 3.988; 3.988 90; 90; 90 | 63.426 | Faber, J.jr.; Lander, G.H.; Brown, P.J.; Delapalme, A. Neutron diffraction study of thermal parameters in U X3 compounds Acta Crystallographica A (24,1968-38,1982), 1981, 37, 558-565 |
| 2310239 | CIF | Nb Ru3 | P m -3 m | 3.88; 3.88; 3.88 90; 90; 90 | 58.411 | Popova, S.V. The crystal structures of new superconducting materials obtained by high pressure treatment Acta Crystallographica A (24,1968-38,1982), 1975, 31, 99-99 |
| 2310269 | CIF | K0.02 Na0.98 Nb O2 | P 2 m m | 7.9004; 7.8362; 7.9376 90; 90; 90 | 491.41 | Athee, M.; Hewat, A.W. Structural Phase Transitions in Sodium-Potassium Niobate Solid Solutions by Neutron Powder Diffraction Acta Crystallographica A (24,1968-38,1982), 1978, 34, 309-317 |
| 2310291 | CIF | Bi1.11 Ca0.8 Cu2 O8.144 Sr1.82 | A m a a | 5.408; 5.413; 30.871 90; 90; 90 | 903.702 | Gao, Y.; Coppens, P.; Cox, D. E.; Moodenbaugh, A. R. Combined x-ray single-crystal and neutron powder refinement of modulated structures and application to the incommensurately modulated structure of Bi~2~Sr~2~CaCu~2~O~8+y~ Acta Crystallographica Section A, 1993, 49, 141-148 |
| 2310292 | CIF | Bi1.05 Ca0.96 Cu2 O8.144 Sr1.75 | A m a a | 5.415; 5.4149; 30.861 90; 90; 90 | 904.896 | Gao, Y.; Coppens, P.; Cox, D. E.; Moodenbaugh, A. R. Combined x-ray single-crystal and neutron powder refinement of modulated structures and application to the incommensurately modulated structure of Bi~2~Sr~2~CaCu~2~O~8+y~ Acta Crystallographica Section A, 1993, 49, 141-148 |
| 2310293 | CIF | Fe0.8 Ga V2.2 | P m -3 n | 4.744; 4.744; 4.744 90; 90; 90 | 106.766 | Girgis, K. Chrystallographic studies on ternary superconductors of the A15 type Acta Crystallographica A (24,1968-38,1982), 1975, 31, 899-899 |
| 2310295 | CIF | Cu0.85 Ga0.15 | F m -3 m | 3.6573; 3.6573; 3.6573 90; 90; 90 | 48.919 | Halder, S.K.; Sen Gupta, S.P. An X-ray determination of the thermal expansion of silver and copper base alloys at high temperatures. II. Cu - Ga Acta Crystallographica A (24,1968-38,1982), 1975, 31, 158-159 |
| 2310325 | CIF | Cu2 Ni Zn | P 4/m m m | 3.635; 3.635; 3.635 90; 90; 90 | 48.03 | van der Vegt, W.H.M.; van der Wegen, G.J.L.; Bronsveld, P.M.; de Hosson, J.T.M. The lattice parameter of Cu2 Ni Zn Acta Crystallographica A (24,1968-38,1982), 1981, 37, 101-101 |
| 2310326 | CIF | Cl4 K2 Zn | P n a m | 9.046; 12.579; 6.882 90; 90; 90 | 783.1 | Ferrari, E. S.; Roberts, K. J.; Thomson, G. B.; Gale, J. D.; Catlow, C. R. A. Interatomic potential parameters for potassium tetrachlorozincate and their application to modelling its phase transformations Acta Crystallographica Section A, 2001, 57, 264-271 |
| 2310327 | CIF | Cl4 K2 Zn | P n a 21 | 27.251; 12.578; 7.239 90; 90; 90 | 2481.26 | Ferrari, E. S.; Roberts, K. J.; Thomson, G. B.; Gale, J. D.; Catlow, C. R. A. Interatomic potential parameters for potassium tetrachlorozincate and their application to modelling its phase transformations Acta Crystallographica Section A, 2001, 57, 264-271 |
| 2310328 | CIF | Al2 O5 Si | P b n m | 7.151; 7.54; 5.918 90; 90; 90 | 319.09 | Oganov, A. P.; Price, G. D.; Brodholt, J. P. Theoretical investigation of metastable Al~2~SiO~5~ polymorphs Acta Crystallographica Section A, 2001, 57, 548-557 |
| 2310329 | CIF | Al2 O5 Si | P n n m | 7.679; 7.727; 5.666 90; 90; 90 | 336.196 | Oganov, A. P.; Price, G. D.; Brodholt, J. P. Theoretical investigation of metastable Al~2~SiO~5~ polymorphs Acta Crystallographica Section A, 2001, 57, 548-557 |
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