#------------------------------------------------------------------------------ #$Date: 2015-07-10 13:19:01 +0300 (Fri, 10 Jul 2015) $ #$Revision: 141755 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/15/1521543.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_1521543 loop_ _publ_author_name 'le Meins, J.M.' 'Crosnier-Lopez, M.P.' 'Hemon-Ribaud, A.' 'Courbion, G.' _publ_section_title ; Phase transitions in the Na3 M2 (P O4)2 F3 family (M = Al(3+), V(3+), Cr(3+), Fe(3+), Ga(3+)) : synthesis, thermal, structural and magnetic studies ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 260 _journal_page_last 277 _journal_volume 148 _journal_year 1999 _chemical_formula_sum 'F3 Na3 O8 P2 V2' _chemical_name_systematic 'Na3 V2 (P O4)2 F3' _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 4 _cell_length_a 9.047 _cell_length_b 9.047 _cell_length_c 10.705 _cell_volume 876.185 _citation_journal_id_ASTM JSSCBI _cod_data_source_file leMeins_JSSCBI_1999_389.cif _cod_data_source_block F3Na3O8P2V2 _cod_original_cell_volume 876.1851 _cod_database_code 1521543 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 F2 F-1 0.2466 0.2466 0.3642 1 0.0 F1 F-1 0.2476 0.2476 0 1 0.0 O2 O-2 0.0947 0.0947 0.1682 1 0.0 Na2 Na+1 0.803 0.0512 0 0.5 0.0 P1 P+5 0 0.5 0.25 1 0.0 O3 O-2 0.4031 0.4031 0.1605 1 0.0 P2 P+5 0 0 0.2553 1 0.0 O1 O-2 0.0969 0.4059 0.1629 1 0.0 Na1 Na+1 0.5234 0.2299 0 1 0.0 V1 V+3 0.24783 0.24783 0.18845 1 0.0