#------------------------------------------------------------------------------ #$Date: 2015-10-13 19:25:47 +0300 (Tue, 13 Oct 2015) $ #$Revision: 167453 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/87/1538767.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_1538767 loop_ _publ_author_name 'Norman, M.' 'Harris, I.R.' _publ_section_title ; A study of some palladium-scandium, -zirconium and -gadolinium alloys ; _journal_name_full 'Journal of the Less-Common Metals' _journal_page_first 333 _journal_page_last 345 _journal_volume 18 _journal_year 1969 _chemical_formula_sum 'Pd3 Sc' _chemical_name_systematic 'Pd3 Sc' _space_group_IT_number 221 _symmetry_space_group_name_Hall '-P 4 2 3' _symmetry_space_group_name_H-M 'P m -3 m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 1 _cell_length_a 3.9579 _cell_length_b 3.9579 _cell_length_c 3.9579 _cell_volume 62.000 _citation_journal_id_ASTM JCOMAH _cod_data_source_file Norman_JCOMAH_1969_1392.cif _cod_data_source_block Pd3Sc1 _cod_original_cell_volume 62.0004 _cod_chemical_formula_sum_orig 'Pd3 Sc1' _cod_database_code 1538767 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 z,x,y -x,z,y -z,-x,y x,-z,y z,-x,-y x,z,-y -z,x,-y -x,-z,-y y,z,x y,-z,-x z,y,-x -y,z,-x -z,-y,-x -y,-z,x z,-y,x -z,y,x -x,-y,-z y,-x,-z x,y,-z -y,x,-z -x,y,z -y,-x,z x,-y,z y,x,z -z,-x,-y x,-z,-y z,x,-y -x,z,-y -z,x,y -x,-z,y z,-x,y x,z,y -y,-z,-x -y,z,x -z,-y,x y,-z,x z,y,x y,z,-x -z,y,-x z,-y,-x 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 Pd1 Pd 0 0.5 0.5 1 0.0 Sc1 Sc 0 0 0 1 0.0