#------------------------------------------------------------------------------ #$Date: 2023-11-10 21:21:08 +0200 (Fri, 10 Nov 2023) $ #$Revision: 287519 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/01/21/9012190.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided the American Mineralogist Crystal Structure Database, # http://rruff.geo.arizona.edu/AMS/amcsd.php # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_9012190 loop_ _publ_author_name 'Eicher, S. M.' 'Greedan, J. E.' 'Lushington, K. J.' _publ_section_title ; The magnetic properties of FeTa2O6. Magnetic structure and low-dimensional behavior Locality: synthetic ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 220 _journal_page_last 230 _journal_paper_doi 10.1016/0022-4596(86)90235-5 _journal_volume 62 _journal_year 1986 _chemical_formula_sum 'Fe O6 Ta2' _chemical_name_mineral Tapiolite-(Fe) _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_length_a 4.749 _cell_length_b 4.749 _cell_length_c 9.192 _cell_volume 207.307 _exptl_crystal_density_diffrn 8.230 _cod_original_formula_sum 'Fe Ta2 O6' _cod_database_code 9012190 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,-x,z y,x,-z 1/2+y,1/2-x,1/2-z 1/2-y,1/2+x,1/2+z 1/2+x,1/2-y,1/2+z 1/2-x,1/2+y,1/2-z x,y,-z -x,-y,z y,x,z -y,-x,-z 1/2-y,1/2+x,1/2-z 1/2+y,1/2-x,1/2+z 1/2-x,1/2+y,1/2+z 1/2+x,1/2-y,1/2-z -x,-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Fe 0.00000 0.00000 0.00000 0.00887 Ta 0.00000 0.00000 0.33300 0.00633 O1 0.30700 0.30700 0.00000 0.00507 O2 0.29700 0.29700 0.32200 0.00887 _cod_duplicate_entry 9012189