############################################################################### # Heiba, Z.K.;Arda, L.;Hascicek, Y.S. (2005) # Journal of Applied Crystallography 38, 306-310 # Structure and microstructure characterization of the mixed sesquioxid\ #es (Gd1-x Ybx)2 O3 and (Gd1-x Hox)2 O3 prepared by sol-gel process # # CIF by ICSD-for-WWW, Copyright 2003 FIZ-Karlsruhe & A.W.Hewat (hewat@ill.fr) # NOT TO BE PUBLISHED IN ANY FORM. See http://icsd.ill.fr/icsd/conditions.html ############################################################################### data_152458-ICSD _database_code_ICSD 152458 _audit_creation_date 2006-10-01 _chemical_name_systematic 'Holmium oxide' _chemical_formula_structural 'Ho2 O3' _chemical_formula_sum 'Ho2 O3' _publ_section_title 'Ho2 O3' loop_ _citation_id _citation_journal_abbrev _citation_year _citation_journal_volume _citation_page_first _citation_page_last _citation_journal_id_ASTM primary 'Journal of Applied Crystallography' 2005 38 306 310 JACGAR loop_ _publ_author_name Heiba, Z.K.;Arda, L.;Hascicek, Y.S. _cell_length_a 10.6175(22) _cell_length_b 10.6175(22) _cell_length_c 10.6175(22) _cell_angle_alpha 90. _cell_angle_beta 90. _cell_angle_gamma 90. _cell_volume 1196.92 _cell_formula_units_Z 16 _symmetry_space_group_name_H-M 'I a -3' _symmetry_Int_Tables_number 206 _refine_ls_R_factor_all 0.052000 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x,y,z' 2 '1/2+x,1/2+y,1/2+z' 3 'x,-y,1/2-z' 4 '1/2+x,1/2-y,-z' 5 'x,1/2-y,1/2+z' 6 '1/2+x,-y,z' 7 '-y,1/2-z,x' 8 '1/2-y,-z,1/2+x' 9 '-y,z,1/2+x' 10 '1/2-y,1/2+z,x' 11 '-z,1/2+x,1/2-y' 12 '1/2-z,x,-y' 13 '-z,x,1/2+y' 14 '1/2-z,1/2+x,y' 15 'z,1/2+x,-y' 16 '1/2+z,x,1/2-y' 17 'z,x,y' 18 '1/2+z,1/2+x,1/2+y' 19 'y,1/2-z,1/2+x' 20 '1/2+y,-z,x' 21 'y,z,x' 22 '1/2+y,1/2+z,1/2+x' 23 'x,1/2+y,-z' 24 '1/2+x,y,1/2-z' 25 '-x,-y,-z' 26 '1/2-x,1/2-y,1/2-z' 27 '-x,y,1/2+z' 28 '1/2-x,1/2+y,z' 29 '-x,1/2+y,1/2-z' 30 '1/2-x,y,-z' 31 'y,1/2+z,-x' 32 '1/2+y,z,1/2-x' 33 'y,-z,1/2-x' 34 '1/2+y,1/2-z,-x' 35 'z,1/2-x,1/2+y' 36 '1/2+z,-x,y' 37 'z,-x,1/2-y' 38 '1/2+z,1/2-x,-y' 39 '-z,1/2-x,y' 40 '1/2-z,-x,1/2+y' 41 '-z,-x,-y' 42 '1/2-z,1/2-x,1/2-y' 43 '-y,1/2+z,1/2-x' 44 '1/2-y,z,-x' 45 '-y,-z,-x' 46 '1/2-y,1/2-z,1/2-x' 47 '-x,1/2-y,z' 48 '1/2-x,-y,1/2+z' loop_ _atom_type_symbol _atom_type_oxidation_number Ho3+ 3. O2- -2. 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_B_iso_or_equiv _atom_site_occupancy Ho1 Ho3+ 8 b 0.250 0.250 0.250 0. 1. Ho2 Ho3+ 24 d 0.96731(11) 0. 0.250 0. 1. O1 O2- 48 e 0.3888(9) 0.1519(8) 0.3811(9) 0. 1. #End of data_152458-ICSD