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


data_5yOhtAoR
_audit_creation_date            2018-10-02
_audit_creation_method          "Bilbao Crystallographic Server"

_citation_journal_abbrev        "Journal of Solid State Chemistry"
_citation_journal_volume        265
_citation_page_first            417
_citation_page_last             423
_citation_article_id            ?
_citation_year                  2018
_citation_DOI                   10.1016/j.jssc.2018.06.013

loop_
_citation_author_name
"R. Dhal"
"P.N. Lekshmi"
"R. Singh"
"A. Das"
"A. Sinha"
"P. Santhosh"




_atomic_positions_source_database_code_ICSD  .
_atomic_positions_source_other               .

_transition_temperature  ?
_experiment_temperature  6

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mGM2+ 1  1  .  primary  5  .

_exptl_crystal_magnetic_properties_details
;
NPD
Magnetically ordered at room temperature. Moments at 300K: Fe1/Cr1: 0.87(3); Fe2: 0.45(9)
;

_active_magnetic_irreps_details
;
1k magnetic structure
k-maximal magnetic symmetry (8 possible)
1-dim irrep active
Weak FM detected. It is symmetry-dictated along the c direction.
;

_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  62.446
_space_group_magn.name_BNS  "P n' m' a"
_cell_length_a             5.38660
_cell_length_b             14.63250
_cell_length_c             5.59720
_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,z+1/2,+1
3 -x,-y,-z,+1
4 x+1/2,y,-z+1/2,+1
5 x+1/2,-y+1/2,-z+1/2,-1
6 -x,y+1/2,-z,-1
7 -x+1/2,y+1/2,z+1/2,-1
8 x,-y+1/2,z,-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
Ca1 Ca 0.48210 0.10830 0.02680 1.
Fe1 Fe 0.00000 0.00000 0.00000 0.79
Cr1 Cr 0.00000 0.00000 0.00000 0.12
Ga2 Ga 0.00000 0.00000 0.00000 0.09
Fe2 Fe 0.44960 0.25000 0.56910 0.09
Ga1 Ga 0.44960 0.25000 0.56910 0.91
O1 O 0.26410 0.98460 0.24010 1.
O2 O 0.02290 0.14110 0.07170 1.
O3 O 0.60390 0.25000 0.87500 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
Fe1 3.15(2) 0.00000 0.00000 mx,my,mz
Cr1 3.15(2) 0.00000 0.00000 mx,my,mz
Fe2 0.93(4) 0.00000 0.00000 mx,0,mz
