The material described by TiVN2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Ti(1) is bonded to six equivalent N(1) atoms to form TiN6 octahedra that share corners with six equivalent V(1)N6 octahedra, edges with six equivalent Ti(1)N6 octahedra, and edges with six equivalent V(1)N6 octahedra. The corner-sharing octahedral tilt angles are 1°. V(1) is bonded to six equivalent N(1) atoms to form VN6 octahedra that share corners with six equivalent Ti(1)N6 octahedra, edges with six equivalent Ti(1)N6 octahedra, and edges with six equivalent V(1)N6 octahedra. The corner-sharing octahedral tilt angles are 1°. N(1) is bonded to three equivalent Ti(1) and three equivalent V(1) atoms to form a mixture of corner and edge-sharing NTi3V3 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF file [CIF]
data_TiVN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.113
_cell_length_b   5.113
_cell_length_c   5.113
_cell_angle_alpha   33.714
_cell_angle_beta   33.714
_cell_angle_gamma   33.714
_symmetry_Int_Tables_number   1
_cell_volume   36.699
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ti  Ti0  1  0.000  0.000  0.000  1.0
  V  V1  1  0.500  0.500  0.500  1.0
  N  N2  1  0.249  0.249  0.249  1.0
  N  N3  1  0.751  0.751  0.751  1.0
[/CIF]
.
The material described by TiVN2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Ti(1) is bonded to six equivalent N(1) atoms to form TiN6 octahedra that share corners with six equivalent V(1)N6 octahedra, edges with six equivalent Ti(1)N6 octahedra, and edges with six equivalent V(1)N6 octahedra. The corner-sharing octahedral tilt angles are 1°. V(1) is bonded to six equivalent N(1) atoms to form VN6 octahedra that share corners with six equivalent Ti(1)N6 octahedra, edges with six equivalent Ti(1)N6 octahedra, and edges with six equivalent V(1)N6 octahedra. The corner-sharing octahedral tilt angles are 1°. N(1) is bonded to three equivalent Ti(1) and three equivalent V(1) atoms to form a mixture of corner and edge-sharing NTi3V3 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF file [CIF]
data_TiVN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.113
_cell_length_b   5.113
_cell_length_c   5.113
_cell_angle_alpha   33.714
_cell_angle_beta   33.714
_cell_angle_gamma   33.714
_symmetry_Int_Tables_number   1
_cell_volume   36.699
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ti  Ti0  1  0.000  0.000  0.000  1.0
  V  V1  1  0.500  0.500  0.500  1.0
  N  N2  1  0.249  0.249  0.249  1.0
  N  N3  1  0.751  0.751  0.751  1.0
[/CIF]
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