#------------------------------------------------------------------------------ #$Date: 2015-01-27 19:58:39 +0000 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: svn://www.crystallography.net/cod/cif/2/00/25/2002511.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_2002511 loop_ _publ_author_name 'Schroeder, F' 'Mueller-Buschbaum, Hk' _publ_section_title ; Europium als Erdalkali- und Lanthanoidelement in Eu Be Eu2 O5 (sowie zur Kenntnis von Ca Be Pr2 O5) ; _journal_name_full ; Zeitschrift fuer Anorganische und Allgemeine Chemie ; _journal_page_first 59 _journal_page_last 64 _journal_paper_doi 10.1002/zaac.19885630109 _journal_volume 563 _journal_year 1988 _chemical_formula_structural 'Eu Be Eu2 O5' _chemical_formula_sum 'Be Eu3 O5' _chemical_name_systematic 'Europium(II) beryllium dieuropium oxide' _space_group_IT_number 14 _symmetry_cell_setting monoclinic _symmetry_Int_Tables_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 90.37(1) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 7.1749(7) _cell_length_b 6.5061(16) _cell_length_c 9.4708(11) _cell_volume 442.1 _refine_ls_R_factor_all 0.07 _cod_database_code 2002511 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,1/2+y,1/2-z -x,-y,-z x,1/2-y,1/2+z loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_attached_hydrogens _atom_site_calc_flag Be1 Be2+ 4 e 0.254(5) 0.193(6) 0.101(4) 1. 0 d Eu1 Eu3+ 4 e 0.2507(2) 0.5960(2) 0.9762(1) 1. 0 d Eu2 Eu3+ 4 e 0.5222(2) 0.9181(2) 0.1755(1) 1. 0 d Eu3 Eu2+ 4 e 0.0202(2) 0.0813(2) 0.8277(1) 1. 0 d O1 O2- 4 e 0.941(3) 0.808(3) 0.432(2) 1. 0 d O2 O2- 4 e 0.443(3) 0.184(3) 0.570(2) 1. 0 d O3 O2- 4 e 0.278(3) 0.668(3) 0.222(2) 1. 0 d O4 O2- 4 e 0.268(3) 0.133(3) 0.274(2) 1. 0 d O5 O2- 4 e 0.266(3) 0.522(3) 0.506(2) 1. 0 d loop_ _atom_type_symbol _atom_type_oxidation_number Be2+ 2.000 Eu3+ 3.000 Eu2+ 2.000 O2- -2.000