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#$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $
#$Revision: 966 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9006100.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_9006100
loop_
_publ_author_name
'Fei Y'
'Mao H K'
'Shu J F'
'Hu J'
_publ_section_title
;
 P-V-T equation of state of magnesiowustite (Mg0.6Fe0.4)O
 Sample: T = 458 deg C, P = 23.82 GPa
 rocksalt structure
;
_journal_name_full               'Physics and Chemistry of Minerals'
_journal_page_first              416
_journal_page_last               422
_journal_volume                  18
_journal_year                    1992
_chemical_formula_sum            'Fe0.4 Mg0.6 O'
_chemical_name_mineral           Magnesiowustite
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.1006
_cell_length_b                   4.1006
_cell_length_c                   4.1006
_cell_volume                     68.951
_diffrn_ambient_pressure         2.382e+07
_diffrn_ambient_temperature      731.15
_[local]_cod_cif_authors_sg_H-M  'F m 3 m'
_[local]_cod_chemical_formula_sum_orig '(Mg.6 Fe.4) O'
loop_
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loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Mg 0.00000 0.00000 0.00000 0.60000
Fe 0.00000 0.00000 0.00000 0.40000
O 0.50000 0.50000 0.50000 1.00000
_cod_database_code 9006100