#------------------------------------------------------------------------------ #$Date: 2014-07-12 11:06:43 +0300 (Sat, 12 Jul 2014) $ #$Revision: 120115 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/01/09/9010923.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_9010923 loop_ _publ_author_name 'Olsen, L. A.' 'Balic-Zunic T' 'Makovicky, E.' 'Ullrich, A.' 'Miletich, R.' _publ_section_title ; Hydrostatic compression of galenobismutite (PbBi2S4): elastic properties and high-pressure crystal chemistry Locality: synthetic Sample: P = 6.06 GPa ; _journal_name_full 'Physics and Chemistry of Minerals' _journal_page_first 467 _journal_page_last 475 _journal_volume 34 _journal_year 2007 _chemical_formula_sum 'Bi2 Pb S4' _chemical_name_mineral Galenobismutite _space_group_IT_number 62 _symmetry_space_group_name_Hall '-P 2c 2n' _symmetry_space_group_name_H-M 'P n a m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 11.3949 _cell_length_b 14.0654 _cell_length_c 3.9591 _cell_volume 634.540 _diffrn_ambient_pressure 6.06e+06 _exptl_crystal_density_diffrn 7.887 _cod_database_code 9010923 loop_ _symmetry_equiv_pos_as_xyz x,y,z x,y,1/2-z -x,-y,1/2+z 1/2-x,1/2+y,1/2+z 1/2+x,1/2-y,1/2-z 1/2+x,1/2-y,z 1/2-x,1/2+y,-z -x,-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Bi1 0.06270 0.39205 0.25000 0.01400 Bi2 0.11090 0.90782 0.25000 0.01410 Pb 0.25970 0.65188 0.25000 0.01770 S1 0.33020 0.01860 0.25000 0.01300 S2 0.26080 0.29650 0.25000 0.01600 S3 0.05280 0.09720 0.25000 0.01000 S4 0.01920 0.71480 0.25000 0.01500 _journal_paper_doi 10.1007/s00269-007-0163-9