#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 27/11/2020 02:04:21
# Parent_293K.cif

data_5yOhtAoR
_audit_creation_date            2020-11-27
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Solid State Sciences"
_citation_journal_volume        80
_citation_page_first            72
_citation_page_last             80
_citation_article_id            .
_citation_year                  2018
_citation_DOI                   10.1016/j.solidstatesciences.2018.03.022

loop_
_citation_author_name
"C.A. Garcia-Ramos"
"S. Larregola"
"M. Retuerto"
"M.T. Fernandez-Diaz"
"K. Krezhov"
"J.A. Alonso"



_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_transition_temperature  175
_experiment_temperature  50


loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM2+  1  1  .  primary  ?  .

_exptl_crystal_magnetic_properties_details
;
NPD
Position structure from a determination at 293K
Non-standard parent setting P2_1/n
Moments have been atributed to the sites, without specific atomic asignments. Here for simplicity they are asigned to the Fe atoms.
Moment components are only approximate (they have been estimated from a figure of the article)
FM on the ac plane
The model can be considered a compensated ferrimagnetic, but the compensation was partially forced by assuming in the refinement equal magnitude and collinearity of the moments in the two independent sites.
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry
1-dim irrep as primary
;

_parent_space_group.name_H-M_alt  'P 2_1/n'
_parent_space_group.IT_number                       14
_parent_space_group.transform_Pp_abc  'a,b,-a+c;0,0,0'

loop_
_parent_propagation_vector.id
_parent_propagation_vector.kxkykz
k1 [0 0 0]

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



_space_group_magn.number_BNS  14.79
_space_group_magn.name_BNS  "P 2_1'/c'"
_cell_length_a             5.40870
_cell_length_b             5.47460
_cell_length_c             7.68230
_cell_angle_alpha          90.00
_cell_angle_beta           90.03
_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,-y,-z,+1
3 -x+1/2,y+1/2,-z+1/2,-1
4 x+1/2,-y+1/2,z+1/2,-1

loop_
_space_group_symop_magn_centering.id
_space_group_symop_magn_centering.xyz
1 x,y,z,+1

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Fe1 Fe 0.50000 0.00000 0.00000 0.7
Mn1 Mn 0.50000 0.00000 0.00000 0.3
W1 W 0.50000 0.00000 0.50000 0.5
Fe2 Fe 0.50000 0.00000 0.50000 0.3
Mn2 Mn 0.50000 0.00000 0.50000 0.2
Ca1 Ca 0.00790 0.03840 0.24900 1.
O1 O 0.29100 0.29100 0.03500 1.
O2 O 0.29600 0.29200 0.45700 1.
O3 O 0.92530 0.48170 0.24900 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
_atom_site_moment.magnitude
Fe1 -1.70000 0.00000 0.50000 mx,my,mz  1.8
Fe2 1.70000 0.00000 -0.50000 mx,my,mz  1.8

