#------------------------------------------------------------------------------ #$Date: 2024-09-19 12:39:42 +0300 (Thu, 19 Sep 2024) $ #$Revision: 294795 $ #$URL: file:///home/coder/svn-repositories/cod/cif/3/00/04/3000496.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_3000496 loop_ _publ_author_name 'Hettler, Simon' 'Singha-Roy, Kankona' 'Arenal, Raul' 'Panchakarla, Leela' _publ_section_title ; Stable CoO~2 Nanoscrolls With Outstanding Electrical Properties ; _journal_name_full 'Advanced Materials Interfaces' _journal_year 2024 _chemical_formula_sum 'Co O2' _chemical_formula_weight 90.93 _chemical_name_common 'cobalt dioxide' _space_group_IT_number 8 _space_group_name_Hall 'C -2y' _space_group_name_H-M_alt 'C 1 m 1' _symmetry_cell_setting monoclinic _cell_angle_alpha 90 _cell_angle_beta 98 _cell_angle_gamma 90 _cell_formula_units_Z 3 _cell_length_a 4.83 _cell_length_b 2.82 _cell_length_c 4.5 _cell_volume 60.696 _diffrn_radiation_type 'electron 300 kV' _journal_article_reference 2400317 _cod_data_source_file CoO2_nanoscrolls.cif _cod_data_source_block cobaltdioxideNSs _cod_depositor_comments 'Releasing structure 3000496 into public domain as published material.' _cod_original_cell_volume 60.806 _cod_original_sg_symbol_H-M 'C m' _cod_database_code 3000496 loop_ _space_group_symop_id _space_group_symop_operation_xyz 1 'x, y, z' 2 'x, -y, z' 3 'x+1/2, y+1/2, z' 4 'x+1/2, -y+1/2, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_occupancy _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type Co Co1 1.0 0.363000 0.000000 0.200000 1 Uiso O O1 1.0 0.727000 0.000000 0.450000 1 Uiso O O2 1.0 0.000000 0.000000 0.000000 1 Uiso loop_ _atom_type_symbol Co O