#------------------------------------------------------------------------------ #$Date: 2015-10-14 19:24:10 +0300 (Wed, 14 Oct 2015) $ #$Revision: 168954 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/98/1539873.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_1539873 loop_ _publ_author_name 'Bronger, W.' 'Auffermann, G.' _publ_section_title ; Darstellung, Struktur und Phasenumwandlung von Rb2 Pd H4 und Cs2 Pd H4 ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 87 _journal_page_last 93 _journal_volume 187 _journal_year 1992 _chemical_formula_sum 'D4 Pd Rb2' _chemical_name_systematic 'Pd Rb2 D4' _space_group_IT_number 136 _symmetry_space_group_name_Hall '-P 4n 2n' _symmetry_space_group_name_H-M 'P 42/m n m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 5.827 _cell_length_b 5.827 _cell_length_c 8.495 _cell_volume 288.439 _citation_journal_id_ASTM JALCEU _cod_data_source_file Bronger_JALCEU_1992_755.cif _cod_data_source_block D4Pd1Rb2 _cod_original_cell_volume 288.4386 _cod_chemical_formula_sum_orig 'D4 Pd1 Rb2' _cod_database_code 1539873 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y+1/2,x+1/2,z+1/2 -x,-y,z y+1/2,-x+1/2,z+1/2 x+1/2,-y+1/2,-z+1/2 y,x,-z -x+1/2,y+1/2,-z+1/2 -y,-x,-z -x,-y,-z y-1/2,-x-1/2,-z-1/2 x,y,-z -y-1/2,x-1/2,-z-1/2 -x-1/2,y-1/2,z-1/2 -y,-x,z x-1/2,-y-1/2,z-1/2 y,x,z 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 0 1 0.0 D2 D 0.2023 0.2023 0 1 0.0 D1 D 0 0 0.1971 1 0.0 Rb1 Rb 0 0.5 0.25 1 0.0