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#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/00/04/1000482.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_1000482
loop_
_publ_author_name
'Attfield, J P'
'Ferey, G'
_publ_section_title
;
Structural correlations within the lanthanum palladium oxide family
;
_journal_coden_ASTM              JSSCBI
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              286
_journal_page_last               298
_journal_paper_doi               10.1016/0022-4596(89)90091-1
_journal_volume                  80
_journal_year                    1989
_chemical_formula_structural     'La2 Pd2 O5'
_chemical_formula_sum            'La2 O5 Pd2'
_chemical_name_systematic        'Lanthanum palladium oxide (2/2/5)'
_space_group_IT_number           84
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      84
_symmetry_space_group_name_Hall  '-P 4c'
_symmetry_space_group_name_H-M   'P 42/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.703(2)
_cell_length_b                   6.703(2)
_cell_length_c                   5.630(2)
_cell_volume                     253.0
_cod_database_code               1000482
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
-y,x,1/2+z
y,-x,1/2+z
-x,-y,-z
x,y,-z
y,-x,1/2-z
-y,x,1/2-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
La1 La3+ 4 j 0.2648(4) 0.1080(6) 0. 1. 0 d
Pd1 Pd2+ 4 j 0.3099(6) 0.5951(6) 0. 1. 0 d
O1 O2- 8 k 0.198(3) 0.402(3) 0.255(3) 1. 0 d
O2 O2- 2 e 0. 0. 0.25 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
La3+ 3.000
Pd2+ 2.000
O2- -2.000