#------------------------------------------------------------------------------ #$Date: 2015-07-14 01:24:19 +0300 (Tue, 14 Jul 2015) $ #$Revision: 151269 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/86/1528692.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_1528692 loop_ _publ_author_name 'Lindberg, F.' 'Drozhzhin, O.A.' 'Warnicke, P.' 'Kaynak, F.B.' 'Istomin, S.Ya.' 'Svensson, G.' 'Svedlindh, P.' 'Wannberg, A.' 'Mellergard, A.' 'Antipov, E.V.' _publ_section_title ; Synthesis and characterization of Sr0.75 Y0.25 Co(1-x) M(x) O(2.625+delta) ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 1434 _journal_page_last 1444 _journal_volume 179 _journal_year 2006 _chemical_formula_sum 'Co0.5 Fe0.5 O2.7 Sr0.75 Y0.25' _chemical_name_systematic 'Sr0.75 Y0.25 Co0.5 Fe0.5 O2.7' _space_group_IT_number 139 _symmetry_space_group_name_Hall '-I 4 2' _symmetry_space_group_name_H-M 'I 4/m m m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 16 _cell_length_a 7.6819 _cell_length_b 7.6819 _cell_length_c 15.3822 _cell_volume 907.728 _citation_journal_id_ASTM JSSCBI _cod_data_source_file Lindberg_JSSCBI_2006_956.cif _cod_data_source_block Co0.5Fe0.5O2.7Sr0.75Y0.25 _cod_original_cell_volume 907.7281 _cod_database_code 1528692 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x,z -x,-y,z y,-x,z x,-y,-z y,x,-z -x,y,-z -y,-x,-z -x,-y,-z y,-x,-z x,y,-z -y,x,-z -x,y,z -y,-x,z x,-y,z y,x,z x+1/2,y+1/2,z+1/2 -y+1/2,x+1/2,z+1/2 -x+1/2,-y+1/2,z+1/2 y+1/2,-x+1/2,z+1/2 x+1/2,-y+1/2,-z+1/2 y+1/2,x+1/2,-z+1/2 -x+1/2,y+1/2,-z+1/2 -y+1/2,-x+1/2,-z+1/2 -x+1/2,-y+1/2,-z+1/2 y+1/2,-x+1/2,-z+1/2 x+1/2,y+1/2,-z+1/2 -y+1/2,x+1/2,-z+1/2 -x+1/2,y+1/2,z+1/2 -y+1/2,-x+1/2,z+1/2 x+1/2,-y+1/2,z+1/2 y+1/2,x+1/2,z+1/2 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 O2 O-2 0.2858 0.2858 0.1186 1 0.0 Sr2 Sr+2 0 0.5 0.8669 1 0.0 Fe2 Fe+3 0.25 0.25 0.25 0.55 0.0 O4 O-2 0.4 0.5 0 0.249 0.0 Fe1 Fe+3 0.253 0.253 0 0.469 0.0 O3 O-2 0 0.72 0 1 0.0 Co1 Co+3 0.253 0.253 0 0.531 0.0 Co2 Co+3 0.25 0.25 0.25 0.45 0.0 Sr1 Sr+2 0 0 0.8751 1 0.0 O1 O-2 0 0.246 0.2389 1 0.0 O5 O-2 0.237 0.5 0 0.151 0.0 Y1 Y+3 0 0 0.3538 1 0.0