#------------------------------------------------------------------------------ #$Date: 2013-05-01 01:24:03 +0300 (Wed, 01 May 2013) $ #$Revision: 83147 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/00/1510036.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_1510036 loop_ _publ_author_name 'Vegard, L.' 'Vasshaug, J.' _publ_section_title ; The crystal structure of Ag3 P O4 and Ag3 As O4 ; _journal_name_full ; Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk-Naturvidenskapelig Klasse ; _journal_page_first 67 _journal_page_last 72 _journal_volume 1947 _journal_year 1947 _chemical_formula_sum 'Ag3 As O4' _chemical_name_systematic 'Ag3 (As O4)' _space_group_IT_number 218 _symmetry_space_group_name_Hall 'P -4n 2 3' _symmetry_space_group_name_H-M 'P -4 3 n' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 6.117 _cell_length_b 6.117 _cell_length_c 6.117 _cell_volume 228.884 _citation_journal_id_ASTM SUNVAQ _[local]_cod_data_source_file silver3-x_8.cif _[local]_cod_data_source_block Ag3As1O4 _[local]_cod_chemical_formula_sum_orig 'Ag3 As1 O4' _cod_database_code 1510036 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,-y,-z -y+1/2,-x+1/2,z+1/2 -x,y,-z y+1/2,x+1/2,z+1/2 z,x,y x+1/2,-z+1/2,-y+1/2 -z,-x,y -x+1/2,z+1/2,-y+1/2 z,-x,-y -x+1/2,-z+1/2,y+1/2 -z,x,-y x+1/2,z+1/2,y+1/2 y,z,x y,-z,-x -z+1/2,-y+1/2,x+1/2 -y,z,-x z+1/2,y+1/2,x+1/2 -y,-z,x -z+1/2,y+1/2,-x+1/2 z+1/2,-y+1/2,-x+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 O1 O-2 0.35 0.35 0.35 1 0.0 Ag1 Ag+1 0.5 0.25 0 1 0.0 As1 As+5 0 0 0 1 0.0