#------------------------------------------------------------------------------ #$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $ #$Revision: 14 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9001666.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_9001666 _chemical_name 'Forsterite' loop_ _publ_author_name 'Artioli G' 'Rinaldi R' 'Wilson C C' 'Zanazzi P F' _journal_name_full "American Mineralogist" _journal_volume 80 _journal_year 1995 _journal_page_first 197 _journal_page_last 200 _publ_section_title ; High-temperature Fe-Mg cation partitioning in olivine: In-situ single-crystal neutron diffraction study T = room temperature Atomic parameters obtained from the ICSD ; _chemical_formula_sum '(Mg1.76 Fe.24) Si O4' _cell_length_a 4.740 _cell_length_b 10.230 _cell_length_c 5.960 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 289.002 _symmetry_space_group_name_H-M 'P b n m' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' 'x,y,1/2-z' '-x,-y,1/2+z' '1/2+x,1/2-y,1/2+z' '1/2-x,1/2+y,1/2-z' '1/2-x,1/2+y,z' '1/2+x,1/2-y,-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Mg1 0.00000 0.00000 0.00000 0.87900 Fe1 0.00000 0.00000 0.00000 0.12100 Mg2 0.98970 0.27880 0.25000 0.88100 Fe2 0.98970 0.27880 0.25000 0.11900 Si 0.42750 0.09370 0.25000 1.00000 O1 0.76660 0.09090 0.25000 1.00000 O2 0.22070 0.44870 0.25000 1.00000 O3 0.27880 0.16370 0.03370 1.00000