#------------------------------------------------------------------------------ #$Date$ #$Revision$ #$URL$ #------------------------------------------------------------------------------ # # 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_9011285 loop_ _publ_author_name 'Reithmayer, K.' 'Steurer, W.' 'Schulz, H.' 'de Boer, J. L.' _publ_section_title ; High-pressure single-crystal structure study on calaverite, AuTe2 Locality: synthetic Sample: P = 2.40 GPa ; _journal_name_full 'Acta Crystallographica, Section B' _journal_page_first 6 _journal_page_last 11 _journal_volume 49 _journal_year 1993 _chemical_formula_sum 'Au Te2' _chemical_name_mineral Calaverite _space_group_IT_number 12 _symmetry_space_group_name_Hall '-C 2y' _symmetry_space_group_name_H-M 'C 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 90.40 _cell_angle_gamma 90 _cell_length_a 7.100 _cell_length_b 4.221 _cell_length_c 5.029 _cell_volume 150.711 _diffrn_ambient_pressure 2.4e+06 _[local]_cod_data_source_file 09029.cif _[local]_cod_data_source_block global loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,1/2+y,z x,-y,z 1/2+x,1/2-y,z -x,y,-z 1/2-x,1/2+y,-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 Au 0.00000 0.00000 0.00000 0.01110 Te 0.67730 0.00000 0.29140 0.01900