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dinosaurwu(½ð±Ò+40): 2011-04-19 08:13:38
wsht212(½ð±Ò+2): лл 2011-04-19 08:35:59
dinosaurwu(½ð±Ò+40): 2011-04-19 08:13:38
wsht212(½ð±Ò+2): лл 2011-04-19 08:35:59
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data_66759-ICSD #?2008 by Fachinformationszentrum Karlsruhe, and the U.S. Secretary of #Commerce on behalf of the United States. All rights reserved. _database_code_ICSD 66759 _audit_creation_date 1995/10/17 _chemical_name_systematic 'Cobalt Diiron(III) Oxide' _chemical_formula_structural '(Co Fe2) O4' _chemical_formula_sum 'Co1 Fe2 O4' _publ_section_title ; A study on the S-block structure in hexagonal ferrites ; loop_ _citation_id _citation_journal_abbrev _citation_year _citation_journal_volume _citation_page_first _citation_page_last _citation_journal_id_ASTM primary 'Yoop Hakoechi (Journal of the Korean Ceramic Society)' 1994 31 62 68 YPHJAP _publ_author_name 'Shin, H.-S.;Lee, J.-H.;Kwon, S.-J.' _cell_length_a 5.9366 _cell_length_b 5.9366 _cell_length_c 14.543 _cell_angle_alpha 90. _cell_angle_beta 90. _cell_angle_gamma 120. _cell_volume 443.87 _cell_formula_units_Z 6 _symmetry_space_group_name_H-M 'R -3 m H' _symmetry_Int_Tables_number 166 _refine_ls_R_factor_all .017 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x-y, -y, -z' 2 '-x, -x+y, -z' 3 'y, x, -z' 4 'x-y, x, -z' 5 'y, -x+y, -z' 6 '-x, -y, -z' 7 '-x+y, y, z' 8 'x, x-y, z' 9 '-y, -x, z' 10 '-x+y, -x, z' 11 '-y, x-y, z' 12 'x, y, z' 13 'x-y+.6666, -y+.3333, -z+.3333' 14 'x-y+.3333, -y+.6666, -z+.6666' 15 '-x+.6666, -x+y+.3333, -z+.3333' 16 '-x+.3333, -x+y+.6666, -z+.6666' 17 'y+.6666, x+.3333, -z+.3333' 18 'y+.3333, x+.6666, -z+.6666' 19 'x-y+.6666, x+.3333, -z+.3333' 20 'x-y+.3333, x+.6666, -z+.6666' 21 'y+.6666, -x+y+.3333, -z+.3333' 22 'y+.3333, -x+y+.6666, -z+.6666' 23 '-x+.6666, -y+.3333, -z+.3333' 24 '-x+.3333, -y+.6666, -z+.6666' 25 '-x+y+.6666, y+.3333, z+.3333' 26 '-x+y+.3333, y+.6666, z+.6666' 27 'x+.6666, x-y+.3333, z+.3333' 28 'x+.3333, x-y+.6666, z+.6666' 29 '-y+.6666, -x+.3333, z+.3333' 30 '-y+.3333, -x+.6666, z+.6666' 31 '-x+y+.6666, -x+.3333, z+.3333' 32 '-x+y+.3333, -x+.6666, z+.6666' 33 '-y+.6666, x-y+.3333, z+.3333' 34 '-y+.3333, x-y+.6666, z+.6666' 35 'x+.6666, y+.3333, z+.3333' 36 'x+.3333, y+.6666, z+.6666' loop_ _atom_type_symbol _atom_type_oxidation_number Co2+ 2 Fe3+ 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_occupancy _atom_site_attached_hydrogens _atom_site_B_iso_or_equiv Co1 Co2+ 6 c 0 0 0.125 0.3333 0 0.69 Fe1 Fe3+ 6 c 0 0 0.125 0.6667 0 0.69 Co2 Co2+ 3 b 0 0 0.5 0.3333 0 0.47 Fe2 Fe3+ 3 b 0 0 0.5 0.6667 0 0.47 Co3 Co2+ 9 e 0.5 0 0 0.3333 0 0.6 Fe3 Fe3+ 9 e 0.5 0 0 0.6667 0 0.6 O1 O2- 6 c 0 0 0.2568 1. 0 0.95 O2 O2- 18 h 0.4911 -.4911 0.2521 1. 0 0.78 #End of data_66759-ICSD |
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