#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/96/1509678.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_1509678 loop_ _publ_author_name 'Stapf, I.' 'Mulokozi, A.M.' 'Gebhardt, E.' _publ_section_title ; The high-temperature modifications of the compounds Pr Ag2 and Nd Ag2 ; _journal_name_full 'Journal of the Less-Common Metals' _journal_page_first P39 _journal_page_last P45 _journal_paper_doi 10.1016/0022-5088(78)90247-3 _journal_volume 57 _journal_year 1978 _chemical_formula_sum 'Ag2 Nd' _chemical_name_systematic 'Ag2 Nd' _space_group_IT_number 191 _symmetry_space_group_name_Hall '-P 6 2' _symmetry_space_group_name_H-M 'P 6/m m m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 1 _cell_length_a 4.789 _cell_length_b 4.789 _cell_length_c 7.06 _cell_volume 140.225 _citation_journal_id_ASTM JCOMAH _cod_data_source_file silver2-3_137.cif _cod_data_source_block Ag2Nd1 _cod_original_cell_volume 140.2249 _cod_original_formula_sum 'Ag2 Nd1' _cod_database_code 1509678 loop_ _symmetry_equiv_pos_as_xyz x,y,z x-y,x,z -y,x-y,z -x,-y,z -x+y,-x,z y,-x+y,z -y,-x,-z x-y,-y,-z x,x-y,-z y,x,-z -x+y,y,-z -x,-x+y,-z -x,-y,-z -x+y,-x,-z y,-x+y,-z x,y,-z x-y,x,-z -y,x-y,-z y,x,z -x+y,y,z -x,-x+y,z -y,-x,z x-y,-y,z x,x-y,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 Nd1 Nd 0 0 0 1 0.0 Ag1 Ag 0.3333 0.6667 0.5 1 0.0