data_2002354 _chemical_name_systematic 'Barium dimagnesium divanadium(V)oxide' _chemical_formula_structural 'Ba Mg2 V2 O8' _chemical_formula_sum 'Ba Mg2 O8 V2' _publ_section_title ; Neue Verbindungen mit Sr Ni2 V2 O8-Struktur: Ba Co2 V2 O8 und Ba Mg2 V2 O8 ; loop_ _publ_author_name 'Wichmann, R' 'Mueller-Buschbaum, Hk' _journal_name_full ; Zeitschrift fuer Anorganische und Allgemeine Chemie ; _journal_volume 534 _journal_year 1986 _journal_page_first 153 _journal_page_last 158 _cell_length_a 12.4189(8) _cell_length_b 12.4189(8) _cell_length_c 8.4657(17) _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 1305.7 _cell_formula_units_Z 8 _symmetry_space_group_name_H-M 'I 41/a c d Z' _symmetry_Int_Tables_number 142 _symmetry_cell_setting tetragonal loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-x,y,1/2+z' '1/4+y,1/4+x,1/4+z' '3/4-y,1/4+x,3/4+z' '-x,-y,-z' 'x,-y,1/2-z' '3/4-y,3/4-x,3/4-z' '1/4+y,3/4-x,1/4-z' 'x,1/2-y,1/2+z' '-x,1/2-y,z' '1/4+y,1/4-x,3/4+z' '3/4-y,1/4-x,1/4+z' '-x,1/2+y,1/2-z' 'x,1/2+y,-z' '3/4-y,3/4+x,1/4-z' '1/4+y,3/4+x,3/4-z' '1/2+x,1/2+y,1/2+z' '1/2-x,1/2+y,z' '3/4+y,3/4+x,3/4+z' '1/4-y,3/4+x,1/4+z' '1/2-x,1/2-y,1/2-z' '1/2+x,1/2-y,-z' '1/4-y,1/4-x,1/4-z' '3/4+y,1/4-x,3/4-z' '1/2+x,-y,z' '1/2-x,-y,1/2+z' '3/4+y,3/4-x,1/4+z' '1/4-y,3/4-x,3/4+z' '1/2-x,y,-z' '1/2+x,y,1/2-z' '1/4-y,1/4+x,3/4-z' '3/4+y,1/4+x,1/4-z' loop_ _atom_type_symbol _atom_type_oxidation_number Ba2+ 2.000 V5+ 5.000 Mg2+ 2.000 O2- -2.000 loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_attached_hydrogens _atom_site_calc_flag Ba1 Ba2+ 8 a 0. 0.25 0.375 1. 0 d V1 V5+ 16 e 0.0810(2) 0. 0.25 1. 0 d Mg1 Mg2+ 16 f 0.1682 0.4182 0.125 1. 0 d O1 O2- 32 g 0.158(1) 0.074(1) 0.384(1) 1. 0 d O2 O2- 32 g 0.499(1) 0.087(1) 0.346(1) 1. 0 d _refine_ls_R_factor_all 0.05