# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 25/02/2018 16:10:28


data_5yOhtAoR
_audit_creation_date            2018-02-25
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "PHYSICAL REVIEW B"
_citation_journal_volume        95
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            174433
_citation_year                  2017
_citation_DOI                   10.1103/PhysRevB.95.174433

loop_
_citation_author_name
"K. Prokes"
"D.I. Gorbunov"
"M. Reehuis"
"B. Klemke"
"A. Gukasov"
"K. Uhlrova"
"X. Fabreges"
"Y. Skourski"
"F. Yokaichiya"
"S. Hartwig"
"A.V. Andreev"




_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_transition_temperature  25
_experiment_temperature  2.4

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mZ4-  1  1  .  primary  2  .

_exptl_crystal_magnetic_properties_details
;
Single crystal ND
Previous models from NPD did not include the magnetic ordering of the Rh atoms (see #1.103)
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry (12 possible if Rh included)
1-dim irrep active
;

_parent_space_group.name_H-M_alt  'P  4/m  b  m  '
_parent_space_group.IT_number                       127
_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;0,0,1/4'



_space_group_magn.number_BNS  135.492
_space_group_magn.name_BNS  "P_c  4_2/m  b  c"
_cell_length_a             7.44900
_cell_length_b             7.44900
_cell_length_c             7.17180
_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 -y,x,z+1/2,+1
3 y,-x,z+1/2,+1
4 x+1/2,-y+1/2,-z+1/2,+1
5 -x+1/2,y+1/2,-z+1/2,+1
6 -x,-y,z,+1
7 y+1/2,x+1/2,-z,+1
8 -y+1/2,-x+1/2,-z,+1
9 -x,-y,-z+1/2,+1
10 y,-x,-z,+1
11 -y,x,-z,+1
12 -x+1/2,y+1/2,z,+1
13 x+1/2,-y+1/2,z,+1
14 x,y,-z+1/2,+1
15 -y+1/2,-x+1/2,z+1/2,+1
16 y+1/2,x+1/2,z+1/2,+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
U1 U 0.17190 0.67190 0.25000
Rh1 Rh 0.36740 0.86740 0.00000
Sn2 Sn 0.00000 0.00000 0.00000

loop_
_atom_site_moment.label
_atom_site_moment.crystalaxis_x
_atom_site_moment.crystalaxis_y
_atom_site_moment.crystalaxis_z
_atom_site_moment.symmform
U1 0.00000 0.00000 0.50(2) 0,0,mz
Rh1 0.04000 0.04 0.00000 mx,mx,0


