#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 11/19/2017 17:16:04
# Database entry: 1.149 La0.8Bi0.2Mn2O5
# Cif-like file for the case 1.149


data_5yOhtAoR
_audit_creation_date            2017-11-19
_audit_creation_method          "Bilbao Crystallographic Server"

_chemical_name_systematic
;
;
_chemical_name_common                    ?
_chemical_formula_moiety                 ?
_chemical_formula_structural             ?
_chemical_formula_analytical             ?
_chemical_formula_iupac                  ?
_chemical_formula_sum                    'La0 .8Bi0 .2Mn2 O5'
_chemical_formula_weight                 ?
_chemical_melting_point                  ?
_chemical_compound_source                ?
_chemical_absolute_configuration         .


_citation_journal_abbrev        "J. Phys.: Condes. Matter"
_citation_journal_volume        25
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            216002
_citation_year                  2013
_citation_DOI                   10.1088/0953-8984/25/21/216002

loop_
_citation_author_name
"M. Retuerto"
"A. Munoz"
"M.J. Martinez-Lope"
"M. Garcia-Hernandez"
"G. Andre"
"K. Krezhov"
"J.A. Alonso"




_atomic_positions_source_database_code_ICSD   188949
_atomic_positions_source_other               .

_transition_temperature     25
_experiment_temperature     1.5

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
? ? ? ? ? ? ?

_exptl_crystal_magnetic_properties_details
;
NPD
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry (8 possible)
1-dim irrep active: equivalent to MSG assignment
;

_parent_space_group.name_H-M_alt  'P  b  a  m'
_parent_space_group.IT_number                       55
_parent_space_group.transform_Pp_abc  'a,b,c;0,0,0'

loop_
_parent_propagation_vector.id
_parent_propagation_vector.kxkykz
k1 [0 0 1/2]

_parent_space_group.child_transform_Pp_abc  'a,b,2c;0,0,0'
_space_group_magn.transform_BNS_Pp_abc  'a,b,c;0,0,0'


_space_group_magn.number_BNS  55.361
_space_group_magn.name_BNS  "P_c  b  a  m"
_space_group_magn.point_group_name  "mmm1'"
_space_group_magn.point_group_number  "8.2.25"
_cell_length_a                 7.64940
_cell_length_b                 8.67420
_cell_length_c                 11.44860
_cell_angle_alpha              90.00
_cell_angle_beta               90.00
_cell_angle_gamma              90.00

loop_
_space_group_symop_magn_operation.id
_space_group_symop_magn_operation.xyz
1 x,y,z,+1
2 x+1/2,-y+1/2,-z,+1
3 -x+1/2,y+1/2,-z,+1
4 -x,-y,z,+1
5 -x,-y,-z,+1
6 -x+1/2,y+1/2,z,+1
7 x+1/2,-y+1/2,z,+1
8 x,y,-z,+1

loop_
_space_group_symop_magn_centering.id
_space_group_symop_magn_centering.xyz
1 x,y,z,+1
2 x,y,z+1/2,-1

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
La1 La 0.14600 0.17220 0.00000 0.8
Bi1 Bi 0.14600 0.17220 0.00000 0.2
Mn1 Mn 0.00000 0.50000 0.12850 1.
Mn2 Mn 0.40600 0.35170 0.25000 1.
O1 O 0.00000 0.00000 0.13900 1.
O2 O 0.15270 0.44920 0.00000 1.
O3 O 0.15020 0.43480 0.25000 1.
O4 O 0.40430 0.20540 0.12750 1.

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
Mn1 0.0 0.0 1.58(8) 0,0,mz
Mn2 -1.55(7) 0.98(11) 0.0 mx,my,0

