#------------------------------------------------------------------------------ #$Date: 2015-09-29 08:12:18 +0300 (Tue, 29 Sep 2015) $ #$Revision: 158838 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/28/1532841.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_1532841 loop_ _publ_author_name 'Lyaskovska, N.' 'Romaniv, O.' 'Gladyshevskii, E.I.' 'Semus'o, N.' _publ_section_title ; Crystal structures of the compounds R Al0.5-x Si0.5+x (R = La, Ce, Pr, Nd, Sm, Gd), R3 Al4 Si6 (R = La, Pr) and R Al Si2 (R = Pr, Nd) ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 180 _journal_page_last 184 _journal_volume 367 _journal_year 2004 _chemical_formula_sum 'Al0.5 Pr Si0.5' _chemical_name_systematic 'Pr (Al0.5 Si0.5)' _space_group_IT_number 63 _symmetry_space_group_name_Hall '-C 2c 2' _symmetry_space_group_name_H-M 'C m c m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 4.4718 _cell_length_b 11.2733 _cell_length_c 4.0701 _cell_volume 205.182 _citation_journal_id_ASTM JALCEU _cod_data_source_file Lyaskovska_JALCEU_2004_1407.cif _cod_data_source_block Al0.5Pr1Si0.5 _cod_original_cell_volume 205.1816 _cod_chemical_formula_sum_orig 'Al0.5 Pr1 Si0.5' _cod_database_code 1532841 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,z+1/2 x,-y,-z -x,y,-z+1/2 -x,-y,-z x,y,-z-1/2 -x,y,z x,-y,z-1/2 x+1/2,y+1/2,z -x+1/2,-y+1/2,z+1/2 x+1/2,-y+1/2,-z -x+1/2,y+1/2,-z+1/2 -x+1/2,-y+1/2,-z x+1/2,y+1/2,-z-1/2 -x+1/2,y+1/2,z x+1/2,-y+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 Al1 Al 0 0.0731 0.25 0.5 0.0 Pr1 Pr 0 0.3566 0.25 1 0.0 Si1 Si 0 0.0731 0.25 0.5 0.0