data_global _amcsd_formula_title 'BaZn2Si2O7' loop_ _publ_author_name 'Lin J H' 'Lu G X' 'Du J' 'Su M Z' 'Loong C K' 'Richardson J W' _journal_name_full 'Journal of Physics and Chemistry of Solids' _journal_volume 60 _journal_year 1999 _journal_page_first 975 _journal_page_last 983 _publ_section_title ; Phase transition and crystal structure of BaZn2Si2O7 Note: T = 350 C ; _database_code_amcsd 0019238 _chemical_compound_source 'Synthetic' _chemical_formula_sum 'Ba Zn2 Si2 O7' _cell_length_a 7.6199 _cell_length_b 13.0265 _cell_length_c 6.7374 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 668.759 _exptl_crystal_density_diffrn 4.333 _symmetry_space_group_name_H-M 'C c m 21' loop_ _space_group_symop_operation_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,z' '1/2+x,1/2-y,z' '-x,-y,1/2+z' '1/2-x,1/2-y,1/2+z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Ba 0.28210 0.00000 -0.12200 0.05020 Zn 0.50600 0.23010 0.11200 0.01640 Si 0.19700 0.11480 0.38100 0.01610 O1 0.11030 0.00000 0.36400 0.02770 O2 0.32810 0.12050 0.19800 0.04190 O3 0.29980 0.13640 0.59100 0.02500 O4 0.03370 0.19630 0.36500 0.03250