#------------------------------------------------------------------------------ #$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176432 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/77/1507756.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_1507756 loop_ _publ_author_name 'Natheer B. Mahmood' 'Emad K. Al-Shakarchi' _publ_section_title ; Three Techniques Used to Produce BaTiO3 Fine Powder ; _journal_name_full 'Journal of Modern Physics' _journal_page_first 1420 _journal_page_last 1428 _journal_paper_doi 10.4236/jmp.2011.211175 _journal_volume 2 _journal_year 2011 _chemical_formula_structural BaTiO3 _chemical_formula_sum 'Ba O3 Ti' _space_group_IT_number 99 _symmetry_Int_Tables_number 99 _symmetry_space_group_name_Hall 'P 4 -2' _symmetry_space_group_name_H-M 'P 4 m m' _audit_creation_date 2012-06-19 _audit_creation_method 'Journal of Modern Physics,' _audit_update_record 2012-06-19 _cell_angle_alpha 90.000 _cell_angle_beta 90.000 _cell_angle_gamma 90.000 _cell_formula_units_Z 1 _cell_length_a 3.9999 _cell_length_b 3.9999 _cell_length_c 4.0170 _cell_volume 64.269 _cod_data_source_file BT.cif _cod_data_source_block BaTiO3 _cod_original_cell_volume 64.3 _cod_original_sg_symbol_Hall P_4_-2 _cod_database_code 1507756 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 x,y,z 2 -y,x,z 3 -x,-y,z 4 y,-x,z 5 -x,y,z 6 x,-y,z 7 -y,-x,z 8 y,x,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_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_calc_flag ba Ba 0.0000 0.0000 0.0000 1.000 1 a d ti Ti 0.5000 0.5000 0.4820 1.000 1 b d o O 0.5000 0.5000 0.0160 1.000 1 b d o O 0.5000 0.0000 0.5150 1.000 2 c d loop_ _atom_type_symbol _atom_type_radius_bond Ba 1.200 Ti 1.200 O 1.200