#------------------------------------------------------------------------------
#$Date: 2015-07-12 16:50:21 +0200 (Sun 12 de Jul de 2015) $
#$Revision: 146918 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/58/1525855.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_1525855
loop_
_publ_author_name
'Lu, Z.-H.'
'Dahn, J.R.'
_publ_section_title
;
 The effect of Co substitution for Ni on the structure and electrochemical
 behaviour of T2 and O2 structure Li2/3 (Cox Ni1/3-x Mn2/3) O2
;
_journal_name_full               'Journal of the Electrochemical Society'
_journal_page_first              237
_journal_page_last               240
_journal_volume                  148
_journal_year                    2001
_chemical_formula_sum            'Co0.0417 Mn0.6667 Na0.6667 Ni0.2916 O2'
_chemical_name_systematic        'Na0.6667 (Co0.0417 Ni0.2916 Mn0.6667) O2'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   2.8778
_cell_length_b                   2.8778
_cell_length_c                   11.1629
_cell_volume                     80.062
_citation_journal_id_ASTM        JESOAN
_cod_data_source_file            Lu_JESOAN_2001_1372.cif
_cod_data_source_block           Co0.0417Mn0.6667Na0.6667Ni0.2916O2
_cod_original_cell_volume        80.06245
_cod_database_code               1525855
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
-y,-x,-z+1/2
x-y,-y,-z
x,x-y,-z+1/2
y,x,-z
-x+y,y,-z+1/2
-x,-x+y,-z
-x,-y,-z
-x+y,-x,-z-1/2
y,-x+y,-z
x,y,-z-1/2
x-y,x,-z
-y,x-y,-z-1/2
y,x,z-1/2
-x+y,y,z
-x,-x+y,z-1/2
-y,-x,z
x-y,-y,z-1/2
x,x-y,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
O1 O-2 0.3333 0.6667 0.0872 1 0.0
Na2 Na+1 0.3333 0.6667 0.75 0.3333 0.0
Co1 Co+2 0 0 0 0.0417 0.0
Ni1 Ni+2 0 0 0 0.2916 0.0
Mn1 Mn+4 0 0 0 0.6667 0.0
Na1 Na+1 0 0 0.25 0.3333 0.0
