#------------------------------------------------------------------------------ #$Date: 2012-02-28 17:44:07 +0200 (Tue, 28 Feb 2012) $ #$Revision: 35913 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/00/78/9007848.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided the American Mineralogist Crystal Structure Database, # http://rruff.geo.arizona.edu/AMS/amcsd.php # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_9007848 loop_ _publ_author_name 'Zhao, J. T.' 'Parthe, E.' _publ_section_title ; Structure of YAlGe and isotypic rare-earth-aluminium germanides ; _journal_name_full 'Acta Crystallographica, Section C' _journal_page_first 2276 _journal_page_last 2279 _journal_volume 46 _journal_year 1990 _chemical_formula_sum 'Al Ge Y' _chemical_name_mineral YAlGe _space_group_IT_number 63 _symmetry_space_group_name_Hall '-C 2c 2' _symmetry_space_group_name_H-M 'C m c m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 4.0504 _cell_length_b 10.440 _cell_length_c 5.7646 _cell_volume 243.763 _exptl_crystal_density_diffrn 5.136 _[local]_cod_chemical_formula_sum_orig 'Y Ge Al' _cod_database_code 9007848 _amcsd_database_code AMCSD#0009937 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,1/2+y,z x,-y,1/2+z 1/2+x,1/2-y,1/2+z -x,y,1/2-z 1/2-x,1/2+y,1/2-z -x,y,z 1/2-x,1/2+y,z x,-y,-z 1/2+x,1/2-y,-z x,y,1/2-z 1/2+x,1/2+y,1/2-z -x,-y,1/2+z 1/2-x,1/2-y,1/2+z -x,-y,-z 1/2-x,1/2-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Y 0.00000 0.30990 0.25000 0.00090 Ge 0.00000 0.60580 0.25000 0.00100 Al 0.00000 0.00000 0.00000 0.00100