#------------------------------------------------------------------------------ #$Date: 2015-09-28 16:07:07 +0300 (Mon, 28 Sep 2015) $ #$Revision: 158628 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/26/1532673.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_1532673 loop_ _publ_author_name 'Lafjij, M.' 'El Jouhari, N.' 'Wallez, G.' 'Benabad, A.' 'le Flem, G.' 'Gravereau, P.' 'Garcia, A.' _publ_section_title ; Structural study and luminescence of Tl Sr La (As O4)2 ; _journal_name_full 'Materials Research Bulletin' _journal_page_first 1755 _journal_page_last 1765 _journal_volume 38 _journal_year 2003 _chemical_formula_sum 'As3 La1.5 O12 Sr1.5 Tl1.5' _chemical_name_systematic 'Tl1.5 (Sr0.5 La0.5)3 (As O4)3' _space_group_IT_number 152 _symmetry_space_group_name_Hall 'P 31 2"' _symmetry_space_group_name_H-M 'P 31 2 1' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 1 _cell_length_a 7.3895 _cell_length_b 7.3895 _cell_length_c 6.8121 _cell_volume 322.138 _citation_journal_id_ASTM MRBUAC _cod_data_source_file Lafjij_MRBUAC_2003_528.cif _cod_data_source_block As3La1.5O12Sr1.5Tl1.5 _cod_original_cell_volume 322.1378 _cod_database_code 1532673 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z+1/3 -x+y,-x,z+2/3 y,x,-z -x,-x+y,-z+1/3 x-y,-y,-z+2/3 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 O2 O-2 0.715 0.167 0.208 1 0.0 O1 O-2 0.399 0.111 0.493 1 0.0 Sr1 Sr+2 0.496 0 0.8333 0.5 0.0 Tl1 Tl+1 0.012 0.01 0.2798 0.25 0.0 La1 La+3 0.496 0 0.8333 0.5 0.0 As1 As+5 0.488 0 0.3333 1 0.0