#------------------------------------------------------------------------------ #$Date: 2015-07-11 15:56:26 +0300 (Sat, 11 Jul 2015) $ #$Revision: 144742 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/40/1524081.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_1524081 loop_ _publ_author_name 'Bodak, O.I.' 'Pecharskii, V.K.' 'Gladyshevskii, E.I.' _publ_section_title ; The system Y-Re-Si and the crystal structures of some new ternary rare earth compounds ; _journal_name_full 'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy' _journal_page_first 250 _journal_page_last 255 _journal_volume 14 _journal_year 1978 _chemical_formula_sum 'Nd2 Re3 Si5' _chemical_name_systematic 'Nd2 Re3 Si5' _space_group_IT_number 128 _symmetry_space_group_name_Hall '-P 4 2n' _symmetry_space_group_name_H-M 'P 4/m n c' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 11 _cell_length_b 11 _cell_length_c 5.652 _cell_volume 683.892 _citation_journal_id_ASTM IVNMAW _cod_data_source_file Bodak_IVNMAW_1978_525.cif _cod_data_source_block Nd2Re3Si5 _cod_database_code 1524081 loop_ _symmetry_equiv_pos_as_xyz 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,-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 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 Re1 Re 0.3764 0.3512 0 1 0.0 Si1 Si 0.184 0.489 0 1 0.0 Si2 Si 0.177 0.677 0.25 1 0.0 Nd1 Nd 0.0757 0.2408 0 1 0.0 Si3 Si 0 0 0.26 1 0.0 Re2 Re 0 0.5 0.25 1 0.0