The crystal structure described by NiBTe is half-Heusler structured and crystallizes in the cubic F-43m space group. Ni(1) is bonded in a body-centered cubic geometry to four equivalent B(1) and four equivalent Te(1) atoms. B(1) is bonded to four equivalent Ni(1) atoms to form distorted BNi4 tetrahedra that share corners with four equivalent Te(1)Ni4 tetrahedra, corners with twelve equivalent B(1)Ni4 tetrahedra, and edges with six equivalent Te(1)Ni4 tetrahedra. Te(1) is bonded to four equivalent Ni(1) atoms to form distorted TeNi4 tetrahedra that share corners with four equivalent B(1)Ni4 tetrahedra, corners with twelve equivalent Te(1)Ni4 tetrahedra, and edges with six equivalent B(1)Ni4 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_NiBTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.039
_cell_length_b   4.039
_cell_length_c   4.039
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   46.603
_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
  Ni  Ni0  1  0.750  0.750  0.750  1.0
  B  B1  1  0.500  0.500  0.500  1.0
  Te  Te2  1  0.000  0.000  0.000  1.0
[/CIF]
.
The crystal structure described by NiBTe is half-Heusler structured and crystallizes in the cubic F-43m space group. Ni(1) is bonded in a body-centered cubic geometry to four equivalent B(1) and four equivalent Te(1) atoms. B(1) is bonded to four equivalent Ni(1) atoms to form distorted BNi4 tetrahedra that share corners with four equivalent Te(1)Ni4 tetrahedra, corners with twelve equivalent B(1)Ni4 tetrahedra, and edges with six equivalent Te(1)Ni4 tetrahedra. Te(1) is bonded to four equivalent Ni(1) atoms to form distorted TeNi4 tetrahedra that share corners with four equivalent B(1)Ni4 tetrahedra, corners with twelve equivalent Te(1)Ni4 tetrahedra, and edges with six equivalent B(1)Ni4 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_NiBTe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.039
_cell_length_b   4.039
_cell_length_c   4.039
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   46.603
_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
  Ni  Ni0  1  0.750  0.750  0.750  1.0
  B  B1  1  0.500  0.500  0.500  1.0
  Te  Te2  1  0.000  0.000  0.000  1.0
[/CIF]
.