#------------------------------------------------------------------------------ #$Date: 2015-07-11 17:13:55 +0300 (Sat, 11 Jul 2015) $ #$Revision: 145187 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/44/1524423.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_1524423 loop_ _publ_author_name 'Givord, F.' 'Lemaire, R.' _publ_section_title ; Structure cristalline du compose intermetallique (Gd2/3 2Fe1/3) Fe5 ; _journal_name_full 'Journal of the Less-Common Metals' _journal_page_first 463 _journal_page_last 568 _journal_volume 21 _journal_year 1970 _chemical_formula_sum 'Fe17 Gd2' _chemical_name_systematic 'Fe17 Gd2' _space_group_IT_number 166 _symmetry_space_group_name_Hall '-R 3 2"' _symmetry_space_group_name_H-M 'R -3 m :H' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 3 _cell_length_a 8.54 _cell_length_b 8.54 _cell_length_c 12.428 _cell_volume 784.960 _citation_journal_id_ASTM JCOMAH _cod_data_source_file Givord_JCOMAH_1970_1934.cif _cod_data_source_block Fe17Gd2 _cod_original_cell_volume 784.9602 _cod_database_code 1524423 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z -x+y,-x,z y,x,-z -x,-x+y,-z x-y,-y,-z -x,-y,-z y,-x+y,-z x-y,x,-z -y,-x,z x,x-y,z -x+y,y,z x+2/3,y+1/3,z+1/3 -y+2/3,x-y+1/3,z+1/3 -x+y+2/3,-x+1/3,z+1/3 y+2/3,x+1/3,-z+1/3 -x+2/3,-x+y+1/3,-z+1/3 x-y+2/3,-y+1/3,-z+1/3 -x+2/3,-y+1/3,-z+1/3 y+2/3,-x+y+1/3,-z+1/3 x-y+2/3,x+1/3,-z+1/3 -y+2/3,-x+1/3,z+1/3 x+2/3,x-y+1/3,z+1/3 -x+y+2/3,y+1/3,z+1/3 x+1/3,y+2/3,z+2/3 -y+1/3,x-y+2/3,z+2/3 -x+y+1/3,-x+2/3,z+2/3 y+1/3,x+2/3,-z+2/3 -x+1/3,-x+y+2/3,-z+2/3 x-y+1/3,-y+2/3,-z+2/3 -x+1/3,-y+2/3,-z+2/3 y+1/3,-x+y+2/3,-z+2/3 x-y+1/3,x+2/3,-z+2/3 -y+1/3,-x+2/3,z+2/3 x+1/3,x-y+2/3,z+2/3 -x+y+1/3,y+2/3,z+2/3 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 Fe4 Fe 0.5 0.5 0.148 1 0.0 Fe1 Fe 0 0 0.096 1 0.0 Fe3 Fe 0.286 0 0 1 0.0 Gd1 Gd 0 0 0.333 1 0.0 Fe2 Fe 0.5 0 0.5 1 0.0