#------------------------------------------------------------------------------ #$Date: 2015-09-28 14:51:14 +0100 (Mon, 28 Sep 2015) $ #$Revision: 158790 $ #$URL: svn://www.crystallography.net/cod/cif/1/53/28/1532803.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_1532803 loop_ _publ_author_name 'Wu, S.Y.' 'Yang, C.C.' 'Tsao, F.C.' 'Li, W.-H.' 'Yang, H.D.' 'Lynn, J.W.' 'Lee, K.C.' _publ_section_title ; Crystal structure and magnetic ordering of Mn and Ce in La0.7 Ce0.15 Ca0.15 Mn O3 ; _journal_name_full 'Journal of Physics: Condensed Matter' _journal_page_first 12585 _journal_page_last 12597 _journal_volume 14 _journal_year 2002 _chemical_formula_sum 'Ca0.147 Ce0.153 La0.7 Mn O3' _chemical_name_systematic '(La0.7 Ce0.153 Ca0.147) (Mn O3)' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90 _cell_angle_beta 90.109 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 7.7655 _cell_length_b 5.5062 _cell_length_c 5.4883 _cell_volume 234.670 _citation_journal_id_ASTM JCOMEL _cod_data_source_file Wu_JCOMEL_2002_740.cif _cod_data_source_block Ca0.147Ce0.153La0.7Mn1O3 _cod_original_cell_volume 234.6705 _cod_chemical_formula_sum_orig 'Ca0.147 Ce0.153 La0.7 Mn1 O3' _cod_database_code 1532803 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y+1/2,-z+1/2 -x,-y,-z x,-y-1/2,z-1/2 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 La1 La+3 0.2508 -0.004 -0.0212 0.7 0.0 Ca1 Ca+2 0.2508 -0.004 -0.0212 0.147 0.0 O1 O-2 0.2495 0.0655 0.5088 0.997 0.0 Mn1 Mn+3 0 0 0.5 1 0.0 O3 O-2 0.464 0.7824 0.2224 0.999 0.0 Ce1 Ce+3 0.2508 -0.004 -0.0212 0.153 0.0 Mn2 Mn+3 0.5 0 0.5 1 0.0 O2 O-2 0.0338 0.7301 0.7223 1.003 0.0