#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/99/1509927.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_1509927 loop_ _publ_author_name 'Kolis, J.W.' 'Schimek, G.L.' 'Pennington, W.T.' 'Emirdag, M.' _publ_section_title ; Synthesis of two new metallic alkali metal silver selenides, K2 Ag12 Se7.11 and Rb Ag5 Se3, from supercritical ethylenediamine ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 287 _journal_page_last 296 _journal_paper_doi 10.1006/jssc.1999.8130 _journal_volume 144 _journal_year 1999 _chemical_formula_sum 'Ag5 Rb Se3' _chemical_name_systematic 'Rb Ag5 Se3' _space_group_IT_number 125 _symmetry_space_group_name_Hall '-P 4a 2b' _symmetry_space_group_name_H-M 'P 4/n b m :2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 6.0814 _cell_length_b 6.0814 _cell_length_c 11.112 _cell_volume 410.960 _citation_journal_id_ASTM JSSCBI _cod_data_source_file silver3-x_220.cif _cod_data_source_block Ag5Rb1Se3 _cod_original_cell_volume 410.9598 _cod_original_formula_sum 'Ag5 Rb1 Se3' _cod_database_code 1509927 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y+1/2,x,z -x+1/2,-y+1/2,z y,-x+1/2,z x,-y+1/2,-z y,x,-z -x+1/2,y,-z -y+1/2,-x+1/2,-z -x,-y,-z y-1/2,-x,-z x-1/2,y-1/2,-z -y,x-1/2,-z -x,y-1/2,z -y,-x,z x-1/2,-y,z y-1/2,x-1/2,z loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Se2 Se-2 0.25 0.25 0.3236 1 0.0 Ag2 Ag+1 -0.4539 0.0461 0.1901 1 0.0 Rb1 Rb+1 0.75 0.25 0.5 1 0.0 Se1 Se-2 0.75 0.25 0 1 0.0 Ag1 Ag+1 0.25 0.25 0 1 0.0