#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/16/1521636.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_1521636 loop_ _publ_author_name 'Mueller-Bunz, H.' 'Schleid, T.' _publ_section_title ; Ueber die Oxidsilicate M2 O (Si O4) der schweren Lanthanoide (M = Dy - Lu) im A-Typ ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 613 _journal_page_last 618 _journal_volume 625 _journal_year 1999 _chemical_formula_sum 'Er2 O5 Si' _chemical_name_systematic 'Er2 O (Si O4)' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90 _cell_angle_beta 105.952 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 8.9964 _cell_length_b 6.8328 _cell_length_c 6.6503 _cell_volume 393.056 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Mueller-Bunz_ZAACAB_1999_890.cif _cod_data_source_block Er2O5Si1 _cod_original_cell_volume 393.0561 _cod_original_formula_sum 'Er2 O5 Si1' _cod_database_code 1521636 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y+1/2,-z+1/2 -x,-y,-z x,-y-1/2,z-1/2 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 Er2 Er+3 0.52634 0.62536 0.23251 1 0.0 Er1 Er+3 0.12419 0.13855 0.43854 1 0.0 O1 O-2 0.2087 0.4285 0.6619 1 0.0 O2 O-2 0.1261 0.4499 0.2743 1 0.0 O4 O-2 0.1055 0.7829 0.4792 1 0.0 O5 O-2 0.386 0.3811 0.0616 1 0.0 Si1 Si+4 0.201 0.589 0.4735 1 0.0 O3 O-2 0.3857 0.6356 0.5073 1 0.0