#------------------------------------------------------------------------------ #$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $ #$Revision: 14 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9009751.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_9009751 _chemical_name 'Fergusonite-beta-(Ce)' loop_ _publ_author_name 'Santoro A' 'Marezio M' 'Roth R S' 'Minor D' _journal_name_full "Journal of Solid State Chemistry" _journal_volume 35 _journal_year 1980 _journal_page_first 167 _journal_page_last 175 _publ_section_title ; Neutron powder diffraction study of the structures of CeTaO4, CeNbO4, and NdTaO4 Locality: synthetic ; _chemical_formula_sum 'Ce Nb O4' _cell_length_a 5.5350 _cell_length_b 11.3991 _cell_length_c 5.1590 _cell_angle_alpha 90 _cell_angle_beta 94.60 _cell_angle_gamma 90 _cell_volume 324.454 _symmetry_space_group_name_H-M 'I 1 2/a 1' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '1/2+x,1/2+y,1/2+z' '1/2-x,y,-z' '-x,1/2+y,1/2-z' '1/2+x,-y,z' '+x,1/2-y,1/2+z' '-x,-y,-z' '1/2-x,1/2-y,1/2-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_Uiso_or_equiv Ce 0.25000 0.12020 0.00000 0.00519 Nb 0.25000 0.64700 0.00000 0.00507 O1 0.01290 0.71710 0.20310 0.00861 O2 0.89990 0.45530 0.23990 0.00760