#------------------------------------------------------------------------------ #$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $ #$Revision: 14 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9001667.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_9001667 _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 = 880 C Atomic parameters obtained from the ICSD ; _chemical_formula_sum '(Mg1.76 Fe.24) Si O4' _cell_length_a 4.76 _cell_length_b 10.33 _cell_length_c 6.05 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 297.483 _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 0.86800 Fe1 0.00000 0.00000 0.00000 0.13200 Mg2 0.99220 0.27820 0.25000 0.89200 Fe2 0.99220 0.27820 0.25000 0.10800 Si 0.42660 0.09440 0.25000 1.00000 O1 0.76710 0.09130 0.25000 1.00000 O2 0.22030 0.45040 0.25000 1.00000 O3 0.28130 0.16300 0.03560 1.00000