#------------------------------------------------------------------------------ #$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $ #$Revision: 966 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/1005033.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_1005033 _chemical_name_systematic 'Cerium palladium antimonide (8/24/1)' _chemical_formula_structural 'Ce8 Pd24 Sb' _chemical_formula_sum 'Ce8 Pd24 Sb' _publ_section_title ; Crystal structure and magnetic susceptibility of Ce8 Pd24 Sb ; loop_ _publ_author_name 'Gordon, R A' 'DiSalvo, F J' _journal_name_full ; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) ; _journal_coden_ASTM ZNBSEN _journal_volume 51 _journal_year 1996 _journal_page_first 52 _journal_page_last 56 _cell_length_a 8.461(1) _cell_length_b 8.461(1) _cell_length_c 8.461(1) _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 605.7 _cell_formula_units_Z 1 _symmetry_space_group_name_H-M 'P m -3 m' _symmetry_Int_Tables_number 221 _symmetry_cell_setting cubic loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' 'y,z,x' 'z,x,y' 'x,z,y' 'y,x,z' 'z,y,x' 'x,-y,-z' 'y,-z,-x' 'z,-x,-y' 'x,-z,-y' 'y,-x,-z' 'z,-y,-x' '-x,y,-z' '-y,z,-x' '-z,x,-y' '-x,z,-y' '-y,x,-z' '-z,y,-x' '-x,-y,z' '-y,-z,x' '-z,-x,y' '-x,-z,y' '-y,-x,z' '-z,-y,x' '-x,-y,-z' '-y,-z,-x' '-z,-x,-y' '-x,-z,-y' '-y,-x,-z' '-z,-y,-x' '-x,y,z' '-y,z,x' '-z,x,y' '-x,z,y' '-y,x,z' '-z,y,x' 'x,-y,z' 'y,-z,x' 'z,-x,y' 'x,-z,y' 'y,-x,z' 'z,-y,x' 'x,y,-z' 'y,z,-x' 'z,x,-y' 'x,z,-y' 'y,x,-z' 'z,y,-x' loop_ _atom_type_symbol _atom_type_oxidation_number Ce0 0.000 Pd0 0.000 Sb0 0.000 loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_attached_hydrogens _atom_site_calc_flag Ce1 Ce0 8 g 0.25140(3) 0.25140(3) 0.25140(3) 1. 0 d Pd1 Pd0 6 f 0.25552(8) 0.5 0.5 1. 0 d Pd2 Pd0 6 e 0.31118(11) 0. 0. 1. 0 d Pd3 Pd0 12 h 0.26675(7) 0.5 0. 1. 0 d Sb1 Sb0 1 a 0. 0. 0. 1. 0 d _refine_ls_R_factor_all 0.022 _cod_database_code 1005033