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#$Date: 2024-04-25 17:59:02 +0300 (Thu, 25 Apr 2024) $
#$Revision: 291351 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/00/55/9005516.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9005516
loop_
_publ_author_name
'Boiocchi, M.'
'Caucia, F.'
'Merli, M.'
'Prella, D.'
'Ungaretti, L.'
_publ_section_title
;
 Crystal-chemical reasons for the immiscibility of periclase and wustite
 under lithospheric P,T conditions
 Sample: after heating to 1100 deg C
;
_journal_name_full               'European Journal of Mineralogy'
_journal_page_first              871
_journal_page_last               881
_journal_paper_doi               10.1127/0935-1221/2001/0013/0871
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'Fe0.01 Mg0.99 O'
_chemical_name_mineral           Periclase
_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                   4.212
_cell_length_b                   4.212
_cell_length_c                   4.212
_cell_formula_units_Z            4
_cell_volume                     74.725
_database_code_amcsd             0006904
_exptl_crystal_density_diffrn    3.611
_exptl_crystal_thermal_history   'after heating to 1100 deg C'
_cod_original_formula_sum        '(Mg.99 Fe.01) O'
_cod_database_code               9005516
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loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Mg 0.00000 0.00000 0.00000 0.99000 0.00443
Fe 0.00000 0.00000 0.00000 0.01000 0.00443
O 0.50000 0.50000 0.50000 1.00000 0.00456
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0006904
