#------------------------------------------------------------------------------ #$Date: 2015-07-11 04:12:17 +0300 (Sat, 11 Jul 2015) $ #$Revision: 144257 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/36/1523636.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_1523636 loop_ _publ_author_name 'Freiburg, C.' 'Grushko, B.' _publ_section_title ; An Al13 Fe4 phase in the Al-Cu-Fe alloy system ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 149 _journal_page_last 152 _journal_volume 210 _journal_year 1994 _chemical_formula_sum 'Al37 Cu2 Fe12' _chemical_name_systematic 'Al37 Cu2 Fe12' _space_group_IT_number 12 _symmetry_space_group_name_Hall '-C 2y' _symmetry_space_group_name_H-M 'C 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 108.07 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 15.603 _cell_length_b 7.9404 _cell_length_c 12.506 _cell_volume 1472.999 _citation_journal_id_ASTM JALCEU _cod_data_source_file Freiburg_JALCEU_1994_1118.cif _cod_data_source_block Al37Cu2Fe12 _cod_database_code 1523636 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z -x,-y,-z x,-y,z x+1/2,y+1/2,z -x+1/2,y+1/2,-z -x+1/2,-y+1/2,-z x+1/2,-y+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 Al1 Al 0 0.25 0 1 0.0 Al2 Al 0.482 0 0.829 1 0.0 Al11 Al 0.487 0.22 0.331 1 0.0 Al6 Al 0.923 0 0.417 1 0.0 Al7 Al 0.696 0 0.229 1 0.0 Fe4 Fe 0.914 0 0.62 1 0.0 Al9 Al 0.181 0.223 0.336 1 0.0 Al8 Al 0.321 0 0.272 1 0.0 Fe5 Fe 0.318 0.305 0.278 1 0.0 Al14 Al 0 0.5 0.5 0.33 0.0 Fe1 Fe 0.395 0 0.629 1 0.0 Al13 Al 0.184 0.22 0.112 1 0.0 Fe2 Fe 0.6 0 0.017 1 0.0 Al12 Al 0.365 0.215 0.11 1 0.0 Al3 Al 0.765 0 0.052 1 0.0 Al4 Al 0.937 0 0.823 1 0.0 Al10 Al 0.367 0.208 0.478 1 0.0 Al15 Al 0.919 0 0.216 0.33 0.0 Cu14 Cu 0 0.5 0.5 0.67 0.0 Cu15 Cu 0.919 0 0.216 0.67 0.0 Fe3 Fe 0.911 0 0.008 1 0.0 Al5 Al 0.768 0 0.457 1 0.0