#------------------------------------------------------------------------------ #$Date: 2015-07-12 22:02:20 +0300 (Sun, 12 Jul 2015) $ #$Revision: 148318 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/70/1527030.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_1527030 loop_ _publ_author_name 'Yoshii, K.' 'Nakamura, A.' 'Ishii, Y.' 'Morii, Y.' _publ_section_title ; Magnetic properties of La1-x Prx Cr O3 ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 84 _journal_page_last 89 _journal_volume 162 _journal_year 2001 _chemical_formula_sum 'Cr La0.5 O3 Pr0.5' _chemical_name_systematic 'La0.5 Pr0.5 Cr O3' _space_group_IT_number 62 _symmetry_space_group_name_Hall '-P 2ac 2n' _symmetry_space_group_name_H-M 'P n m a' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 5.4722 _cell_length_b 7.7255 _cell_length_c 5.474 _cell_volume 231.416 _citation_journal_id_ASTM JSSCBI _cod_data_source_file Yoshii_JSSCBI_2001_1742.cif _cod_data_source_block Cr1La0.5O3Pr0.5 _cod_chemical_formula_sum_orig 'Cr1 La0.5 O3 Pr0.5' _cod_database_code 1527030 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x+1/2,-y,z+1/2 x+1/2,-y+1/2,-z+1/2 -x,y+1/2,-z -x,-y,-z x-1/2,y,-z-1/2 -x-1/2,y-1/2,z-1/2 x,-y-1/2,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 O1 O-2 0.4859 0.25 0.0675 1 0.0 O2 O-2 0.2159 0.5395 0.2208 1 0.0 Cr1 Cr+3 0 0 0.5 1 0.0 Pr1 Pr+3 0.0285 0.25 -0.0043 0.5 0.0 La1 La+3 0.0285 0.25 -0.0043 0.5 0.0