#------------------------------------------------------------------------------ #$Date: 2015-07-12 19:53:27 +0300 (Sun, 12 Jul 2015) $ #$Revision: 147647 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/64/1526458.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_1526458 loop_ _publ_author_name 'Ivanov, S.A.' 'Orlov, V.G.' 'Tellgren, R.' 'Rundlof, H.' _publ_section_title ; Structural studies of alpha-(Bi2 O3) by neutron powder diffraction ; _journal_name_full 'Powder Diffraction' _journal_page_first 227 _journal_page_last 230 _journal_volume 16 _journal_year 2001 _chemical_formula_sum 'Bi2 O3' _chemical_name_systematic 'Bi2 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 112.97 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 5.8444 _cell_length_b 8.1574 _cell_length_c 7.5032 _cell_volume 329.352 _citation_journal_id_ASTM PODIE2 _cod_data_source_file Ivanov_PODIE2_2001_1874.cif _cod_data_source_block Bi2O3 _cod_original_cell_volume 329.3523 _cod_database_code 1526458 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 O1 O-2 0.7771 0.3043 0.7074 1 0.0 Bi1 Bi+3 0.5227 0.1837 0.3615 1 0.0 O3 O-2 0.268 0.0283 0.5106 1 0.0 Bi2 Bi+3 0.0401 0.0426 0.7762 1 0.0 O2 O-2 0.2351 0.0477 0.1272 1 0.0