The structure described by TiSe is Tungsten Carbide-like structured and crystallizes in the hexagonal P6_3/mmc space group. Ti(1) is bonded to six equivalent Se(1) atoms to form a mixture of edge, face, and corner-sharing TiSe6 octahedra. The corner-sharing octahedral tilt angles are 45°. Se(1) is bonded to six equivalent Ti(1) atoms to form a mixture of distorted edge and corner-sharing SeTi6 pentagonal pyramids. is represented by the CIF card [CIF]
data_TiSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.429
_cell_length_b   3.429
_cell_length_c   6.765
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   68.893
_cell_formula_units_Z   2
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
  Ti  Ti1  1  0.000  0.000  0.500  1.0
  Se  Se2  1  0.333  0.667  0.250  1.0
  Se  Se3  1  0.667  0.333  0.750  1.0
[/CIF]
.
The structure described by TiSe is Tungsten Carbide-like structured and crystallizes in the hexagonal P6_3/mmc space group. Ti(1) is bonded to six equivalent Se(1) atoms to form a mixture of edge, face, and corner-sharing TiSe6 octahedra. The corner-sharing octahedral tilt angles are 45°. Se(1) is bonded to six equivalent Ti(1) atoms to form a mixture of distorted edge and corner-sharing SeTi6 pentagonal pyramids. is represented by the CIF card [CIF]
data_TiSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.429
_cell_length_b   3.429
_cell_length_c   6.765
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   68.893
_cell_formula_units_Z   2
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
  Ti  Ti1  1  0.000  0.000  0.500  1.0
  Se  Se2  1  0.333  0.667  0.250  1.0
  Se  Se3  1  0.667  0.333  0.750  1.0
[/CIF]
.