#------------------------------------------------------------------------------ #$Date: 2015-09-18 07:57:31 +0300 (Fri, 18 Sep 2015) $ #$Revision: 157732 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/21/1532103.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_1532103 loop_ _publ_author_name 'Rizzoli, C.' 'Salamakha, P.S.' 'Belletti, D.' 'Sologub, O.L.' _publ_section_title ; Single crystal investigation of the Nd (Fe0.45 Ru0.55)2 Si2, Nd (Fe0.60 Os0.40)2 Si2 and Nd (Ru0.95 Os0.05)2 Si2 compounds ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first L8 _journal_page_last L11 _journal_volume 353 _journal_year 2003 _chemical_formula_sum 'Nd Os0.1 Ru1.9 Si2' _chemical_name_systematic 'Nd (Ru0.95 Os0.05)2 Si2' _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 2 _cell_length_a 4.191 _cell_length_b 4.191 _cell_length_c 9.808 _cell_volume 172.272 _citation_journal_id_ASTM JALCEU _cod_data_source_file Rizzoli_JALCEU_2003_1393.cif _cod_data_source_block Nd1Os0.1Ru1.9Si2 _cod_original_cell_volume 172.2724 _cod_chemical_formula_sum_orig 'Nd1 Os0.1 Ru1.9 Si2' _cod_database_code 1532103 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 Os1 Os 0 0.5 0.25 0.05 0.0 Nd1 Nd 0 0 0 1 0.0 Si1 Si 0 0 0.3662 1 0.0 Ru1 Ru 0 0.5 0.25 0.95 0.0