#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 29/02/2020

data_5yOhtAoR
_audit_creation_date            2020-02-29
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "PHYSICAL REVIEW B"
_citation_journal_volume        101
_citation_page_first            ?
_citation_page_last             ?
_citation_article_id            054442
_citation_year                  2020
_citation_DOI                   10.1103/PhysRevB.101.054442

loop_
_citation_author_name
"A. Donni"
"V.Y. Pomjakushin"
"L. Zhang"
"K. Yamaura"
"A.A. Belik"




_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_transition_temperature  104
_experiment_temperature  1.8

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM3+  1  1  .  primary  7  .

_exptl_crystal_magnetic_properties_details
;
NPD
Positional structure from a 130K measurement
Another alternative model with a common average magnetic moment for the Tm1/Mn1 mixed site is also reported
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry (8 possible)
1-dim irrep primary
;

_parent_space_group.name_H-M_alt  'P n m a'
_parent_space_group.IT_number                       62
_parent_space_group.transform_Pp_abc  'a,b,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,c;0,0,0'



_space_group_magn.number_BNS  62.447
_space_group_magn.name_BNS  "P n m' a'"
_cell_length_a             5.52560
_cell_length_b             7.37070
_cell_length_c             5.21670
_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+1/2,+1
3 -x,-y,-z,+1
4 -x+1/2,y+1/2,z+1/2,+1
5 -x,y+1/2,-z,-1
6 -x+1/2,-y,z+1/2,-1
7 x,-y+1/2,z,-1
8 x+1/2,y,-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
Tm1 Tm 0.07590 0.25000 0.98260 0.698
Mn1 Mn 0.07590 0.25000 0.98260 0.302
Mn2 Mn 0.00000 0.00000 0.50000 1.
O1 O 0.45750 0.25000 0.10760 1.
O2 O 0.31510 0.05390 0.69310 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
Tm1 -3.82(3) 0.00000 3.25(3) mx,0,mz
Mn1 -3.93(2) 0.00000 0.00000 mx,0,mz
Mn2 -3.20(2) 0.00000 0.00000 mx,my,mz

