#------------------------------------------------------------------------------ #$Date: 2015-07-17 16:24:32 +0300 (Fri, 17 Jul 2015) $ #$Revision: 152166 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/91/1529103.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_1529103 loop_ _publ_author_name 'Berger, R.' _publ_section_title ; The crystal structure of V3 As2 ; _journal_name_full 'Acta Chemica Scandinavica, Series A: (28,1974-)' _journal_page_first 287 _journal_page_last 291 _journal_volume 31 _journal_year 1977 _chemical_formula_sum 'As2 V3' _chemical_name_systematic 'V3 As2' _space_group_IT_number 83 _symmetry_space_group_name_Hall '-P 4' _symmetry_space_group_name_H-M 'P 4/m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 9.4128 _cell_length_b 9.4128 _cell_length_c 3.3361 _cell_volume 295.581 _citation_journal_id_ASTM ACAPCT _cod_data_source_file Berger_ACAPCT_1977_40.cif _cod_data_source_block As2V3 _cod_original_cell_volume 295.5811 _cod_database_code 1529103 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x,z -x,-y,z y,-x,z -x,-y,-z y,-x,-z x,y,-z -y,x,-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 V2 V 0.39694 0.28477 0 1 0.0 As1 As 0.24604 0.41181 0.5 1 0.0 V5 V 0 0 0 1 0.0 V4 V 0.5 0.5 0.5 1 0.0 V1 V 0.13335 0.17927 0.5 1 0.0 V3 V 0 0.5 0.5 1 0.0 As2 As 0.28481 0.03946 0 1 0.0