#\#CIF_2.0
# Created by the Bilbao Crystallographic Server
# http://www.cryst.ehu.es
# Date: 11/19/2017 17:06:32
# Database entry: 1.24 ZnV2O4
# Cif-like file for the case 1.24


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                    'Zn V2 O4'
_chemical_formula_weight                 ?
_chemical_melting_point                  ?
_chemical_compound_source                ?
_chemical_absolute_configuration         .


_citation_journal_abbrev        "The European Physical Journal B"
_citation_journal_volume        35
_citation_page_first            311
_citation_page_last             316
_citation_article_id            .
_citation_year                  2003
_citation_DOI                   10.1140/epjb/e2003-00282-4

loop_
_citation_author_name
"M. Reehuis"
"A. Krimmel"
"N. B�ttgen"
"A. Loidl"
"A. Prokofiev"





_atomic_positions_source_database_code_ICSD   55443
_atomic_positions_source_other               .

_transition_temperature     40
_experiment_temperature     1.8

loop_
_irrep_id
_irrep_dimension
_irrep_small_dimension
_irrep_direction_type
_irrep_action
_irrep_modes_number
_irrep_presence
mM4 2 2 special primary . .

_exptl_crystal_magnetic_properties_details
;
NPD
;

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

_parent_space_group.name_H-M_alt  'I  4_1/a  m  d'
_parent_space_group.IT_number                       141
_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]

_parent_space_group.child_transform_Pp_abc  'a,b,c;0,0,0'
_space_group_magn.transform_BNS_Pp_abc  'a,b,c;1/4,0,1/8'


_space_group_magn.number_BNS  96.150
_space_group_magn.name_BNS  "P_I  4_32_12"
_space_group_magn.point_group_name  "4221'"
_space_group_magn.point_group_number  "12.2.41"
_cell_length_a                 5.95260
_cell_length_b                 5.95260
_cell_length_c                 8.37440
_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+3/4,x+1/4,z+3/4,+1
3 y+3/4,-x+3/4,z+1/4,+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 y+1/4,x+3/4,-z+1/4,+1
8 -y+1/4,-x+1/4,-z+3/4,+1

loop_
_space_group_symop_magn_centering.id
_space_group_symop_magn_centering.xyz
1 x,y,z,+1
2 x+1/2,y+1/2,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
Zn1 Zn 0.00000 0.75000 0.12500 1
V1 V 0.00000 0.00000 0.50000 1
O1 O 0.00000 0.02000 0.26110 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
V1 0.0 0.0 0.65 0,my,mz

