#------------------------------------------------------------------------------ #$Date: 2015-07-13 20:10:11 +0300 (Mon, 13 Jul 2015) $ #$Revision: 150341 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/83/1528311.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_1528311 loop_ _publ_author_name 'Andreassen Delphin, I.L.' 'Selte, K.' 'Andresen, A.F.' 'Kjekshus, A.' _publ_section_title ; Structural and magnetic properties of Cr1-t Nit As, Mn1-t Nit As and Fe1-t Nit As ; _journal_name_full 'Acta Chemica Scandinavica, Series A: (28,1974-)' _journal_page_first 179 _journal_page_last 185 _journal_volume 32 _journal_year 1978 _chemical_formula_sum 'As Cr0.95 Ni0.05' _chemical_name_systematic 'Cr0.95 Ni0.05 As' _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 5.6173 _cell_length_b 3.3932 _cell_length_c 6.199 _cell_volume 118.157 _citation_journal_id_ASTM ACAPCT _cod_data_source_file AndreassenDelphin_ACAPCT_1978_74.cif _cod_data_source_block As1Cr0.95Ni0.05 _cod_original_cell_volume 118.1568 _cod_chemical_formula_sum_orig 'As1 Cr0.95 Ni0.05' _cod_database_code 1528311 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 As1 As 0.1996 0.25 0.5734 1 0.0 Ni1 Ni 0.0092 0.25 0.1978 0.05 0.0 Cr1 Cr 0.0092 0.25 0.1978 0.95 0.0