#------------------------------------------------------------------------------ #$Date: 2008-04-03 12:11:48 +0200 (Thu, 03 Apr 2008) $ #$Revision: 326 $ #$URL: svn://www.crystallography.net/cod/cif/2/2100731.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_2100731 loop_ _publ_author_name 'Edstr\"om, K.' 'Thomas, J. O.' 'Farrington, G. C.' _publ_section_title ; A single-crystal X-ray diffraction study of the ion exchange of Cd^2+^ into Ag^+^ \b-alumina ; _journal_issue 5 _journal_name_full 'Acta Crystallographica Section B' _journal_page_first 643 _journal_page_last 650 _journal_volume 47 _journal_year 1991 _chemical_formula_sum 'Ag1 Al11 O17.11' _chemical_formula_weight 702.1 _symmetry_cell_setting hexagonal _symmetry_space_group_name_Hall '-P 6c 2c' _symmetry_space_group_name_H-M P63/mmc _cell_formula_units_Z 2 _cell_length_a 5.5914(3) _cell_length_b 5.5914(3) _cell_length_c 22.430(4) _cell_volume 607.29 _diffrn_radiation_type mo _diffrn_radiation_wavelength 0.71073 _exptl_absorpt_coefficient_mu 2.93 _exptl_crystal_density_diffrn 3.82 _exptl_crystal_F_000 674.4 _[local]_cod_data_source_file ab0142.cif loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Ag(1) .7048(2) -.7048(2) .25 .547(5) Ag(2) .7780(15) -.7780(15) .25 .58(2) Ag(3) .9763(5) -.9763(5) .25 .655(8) O(5) .3333 .6667 .25 .91(2) Al(1) -.16800(3) -.33600(3) .106500(10) 6.3 Al(2) .3333 .6667 .024950(10) 5.1 Al(3) .3333 .6667 .17573(2) 7.4 Al(4) 0 0 0 5.6 O(1) .15699(6) .31398(6) .05020(3) 6.4 O(2) .50288(6) -.50288(6) .14646(3) 7.8 O(3) .6667 .3333 .05536(5) 6.5 O(4) 0 0 .14299(5) 4.7 Al(5) -.1596(7) -.3192(7) .1757(3) 6.3 O(6) .8333 .1667 .25 3.0