#------------------------------------------------------------------------------ #$Date: 2015-07-12 17:45:53 +0300 (Sun, 12 Jul 2015) $ #$Revision: 146903 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/58/1525840.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_1525840 loop_ _publ_author_name 'Lomnitskaya, Ya.F.' 'Chikhrii, S.I.' 'Kuz'ma, Yu.B.' _publ_section_title ; The interaction of phosphorus with titanium and molybdenum ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 91 _journal_page_last 96 _journal_volume 321 _journal_year 2001 _chemical_formula_sum 'Mo0.1 P Ti0.9' _chemical_name_systematic '(Ti0.9 Mo0.1) P' _space_group_IT_number 187 _symmetry_space_group_name_Hall 'P -6 2' _symmetry_space_group_name_H-M 'P -6 m 2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 1 _cell_length_a 3.2191 _cell_length_b 3.2191 _cell_length_c 3.1995 _cell_volume 28.713 _citation_journal_id_ASTM JALCEU _cod_data_source_file Lomnitskaya_JALCEU_2001_1274.cif _cod_data_source_block Mo0.1P1Ti0.9 _cod_original_cell_volume 28.71321 _cod_chemical_formula_sum_orig 'Mo0.1 P1 Ti0.9' _cod_database_code 1525840 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 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 P1 P 0.3333 0.6667 0.5 1 0.0 Mo1 Mo 0 0 0 0.1 0.0 Ti1 Ti 0 0 0 0.9 0.0