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#$Date: 2015-10-05 12:55:59 +0200 (lun 05 de oct de 2015) $
#$Revision: 160033 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/37/1533760.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_1533760
loop_
_publ_author_name
'Bertini, L.'
'Stiewe, C.'
'Gatti, C.'
'Williams, S.'
'Toprak, M.'
'Mrotzek, A.'
'Zhang Yu'
'Muhammed, M.'
'Platzek, D.'
'Mueller, E.'
'Rowe, M.'
_publ_section_title
;
 Nanostructured Co1-x Nix Sb3 skutterudites: synthesis, thermoelectric
 properties and theoretical modelling
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              438
_journal_page_last               447
_journal_volume                  93
_journal_year                    2003
_chemical_formula_sum            'Co0.875 Ni0.125 Sb3'
_chemical_name_systematic        '(Co0.875 Ni0.125) Sb3'
_space_group_IT_number           204
_symmetry_space_group_name_Hall  '-I 2 2 3'
_symmetry_space_group_name_H-M   'I m -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.15
_cell_length_b                   9.15
_cell_length_c                   9.15
_cell_volume                     766.061
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            Bertini_JAPIAU_2003_354.cif
_cod_data_source_block           Co0.875Ni0.125Sb3
_cod_original_cell_volume        766.0608
_cod_database_code               1533760
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
x,-y,-z
-x,y,-z
z,x,y
-z,-x,y
z,-x,-y
-z,x,-y
y,z,x
y,-z,-x
-y,z,-x
-y,-z,x
-x,-y,-z
x,y,-z
-x,y,z
x,-y,z
-z,-x,-y
z,x,-y
-z,x,y
z,-x,y
-y,-z,-x
-y,z,x
y,-z,x
y,z,-x
x+1/2,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+1/2,-z+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+1/2
-z+1/2,x+1/2,-y+1/2
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+1/2,-z+1/2,x+1/2
-x+1/2,-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+1/2,z+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+1/2
z+1/2,-x+1/2,y+1/2
-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+1/2,z+1/2,-x+1/2
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
Co1 Co 0.25 0.25 0.25 0.875 0.0
Ni1 Ni 0.25 0.25 0.25 0.125 0.0
Sb1 Sb 0 0.3358 0.1588 1 0.0
