#------------------------------------------------------------------------------ #$Date: 2009-11-16 03:43:51 +0200 (Mon, 16 Nov 2009) $ #$Revision: 853 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/1004117.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_1004117 _chemical_name_systematic 'Europium bismuth vanadate (0.28/0.72/1)' _chemical_formula_structural '(Eu0.28 Bi0.72) (V O4)' _chemical_formula_sum 'Bi.72 Eu.28 O4 V' _publ_section_title ; Synthesis and structural investigation of the Eu1-x Bix V O4 scheelite phase: X-ray diffraction, Raman scattering and Eu(3+) luminescence ; _space_group_IT_number 88 _symmetry_space_group_name_Hall '-I 4ad' _symmetry_space_group_name_H-M 'I 41/a :2' _[local]_cod_cif_authors_sg_H-M 'I 41/a Z' loop_ _publ_author_name 'Blin, J L' 'Lorriaux-Rubbens, A' 'Wallart, F' 'Wignacourt, J P' _journal_name_full 'Journal of Materials Chemistry' _journal_coden_ASTM JMACEP _journal_volume 6 _journal_year 1996 _journal_page_first 385 _journal_page_last 389 _journal_issue 3 _cell_length_a 7.28296(9) _cell_length_b 7.28296(9) _cell_length_c 6.43407(10) _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 341.3 _cell_formula_units_Z 4 _symmetry_cell_setting tetragonal loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-x,1/2-y,z' '3/4-y,1/4+x,1/4+z' '1/4+y,1/4-x,1/4+z' '-x,-y,-z' 'x,1/2+y,-z' '1/4+y,3/4-x,3/4-z' '3/4-y,3/4+x,3/4-z' '1/2+x,1/2+y,1/2+z' '1/2-x,-y,1/2+z' '1/4-y,3/4+x,3/4+z' '3/4+y,3/4-x,3/4+z' '1/2-x,1/2-y,1/2-z' '1/2+x,y,1/2-z' '3/4+y,1/4-x,1/4-z' '1/4-y,1/4+x,1/4-z' loop_ _atom_type_symbol _atom_type_oxidation_number Bi3+ 3.000 Eu3+ 3.000 V5+ 5.000 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 Bi1 Bi3+ 4 b 0. 0.25 0.625 0.72 0 d Eu1 Eu3+ 4 b 0. 0.25 0.625 0.28 0 d V1 V5+ 4 a 0. 0.25 0.125 1. 0 d O1 O2- 16 f 0.1778(7) 0.743(6) 0.0429(8) 1. 0 d _refine_ls_R_factor_all 0.026