#------------------------------------------------------------------------------ #$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $ #$Revision: 211196 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/69/1526992.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_1526992 loop_ _publ_author_name 'Yamane, H.' 'Shimada, M.' 'Okabe, T.H.' 'Waseda, Y.' 'Ishiyama, O.' _publ_section_title ; Ternary nitrides prepared in the (Li3 N)-(Mg3 N2) system at 900 - 1000 K ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 124 _journal_page_last 130 _journal_volume 319 _journal_year 2001 _chemical_formula_sum 'Li Mg N' _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 7.1586 _cell_length_b 3.50691 _cell_length_c 5.01424 _cell_volume 125.880 _citation_journal_id_ASTM JALCEU _cod_data_source_file Yamane_JALCEU_2001_1235.cif _cod_data_source_block Li1Mg1N1 _cod_original_cell_volume 125.8803 _cod_original_formula_sum 'Li1 Mg1 N1' _cod_database_code 1526992 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 Mg1 Mg+2 0.1442 0.25 0.0203 1 0.0 Li1 Li+1 0.0948 0.25 0.5281 1 0.0 N1 N-3 0.3792 0.25 0.269 1 0.0