The crystal structure described by TiZr crystallizes in the hexagonal P-6m2 space group. Zr(1) is bonded to six equivalent Zr(1) and six equivalent Ti(1) atoms to form ZrZr6Ti6 cuboctahedra that share corners with eighteen equivalent Zr(1)Zr6Ti6 cuboctahedra, edges with six equivalent Zr(1)Zr6Ti6 cuboctahedra, edges with twelve equivalent Ti(1)Zr6Ti6 cuboctahedra, faces with eight equivalent Zr(1)Zr6Ti6 cuboctahedra, and faces with twelve equivalent Ti(1)Zr6Ti6 cuboctahedra. Ti(1) is bonded to six equivalent Zr(1) and six equivalent Ti(1) atoms to form TiZr6Ti6 cuboctahedra that share corners with eighteen equivalent Ti(1)Zr6Ti6 cuboctahedra, edges with six equivalent Ti(1)Zr6Ti6 cuboctahedra, edges with twelve equivalent Zr(1)Zr6Ti6 cuboctahedra, faces with eight equivalent Ti(1)Zr6Ti6 cuboctahedra, and faces with twelve equivalent Zr(1)Zr6Ti6 cuboctahedra. is represented by the CIF card [CIF]
data_ZrTi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.109
_cell_length_b   3.109
_cell_length_c   4.920
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   41.189
_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
  Zr  Zr0  1  0.000  0.000  0.000  1.0
  Ti  Ti1  1  0.333  0.667  0.500  1.0
[/CIF]
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The crystal structure described by TiZr crystallizes in the hexagonal P-6m2 space group. Zr(1) is bonded to six equivalent Zr(1) and six equivalent Ti(1) atoms to form ZrZr6Ti6 cuboctahedra that share corners with eighteen equivalent Zr(1)Zr6Ti6 cuboctahedra, edges with six equivalent Zr(1)Zr6Ti6 cuboctahedra, edges with twelve equivalent Ti(1)Zr6Ti6 cuboctahedra, faces with eight equivalent Zr(1)Zr6Ti6 cuboctahedra, and faces with twelve equivalent Ti(1)Zr6Ti6 cuboctahedra. Ti(1) is bonded to six equivalent Zr(1) and six equivalent Ti(1) atoms to form TiZr6Ti6 cuboctahedra that share corners with eighteen equivalent Ti(1)Zr6Ti6 cuboctahedra, edges with six equivalent Ti(1)Zr6Ti6 cuboctahedra, edges with twelve equivalent Zr(1)Zr6Ti6 cuboctahedra, faces with eight equivalent Ti(1)Zr6Ti6 cuboctahedra, and faces with twelve equivalent Zr(1)Zr6Ti6 cuboctahedra. is represented by the CIF card [CIF]
data_ZrTi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.109
_cell_length_b   3.109
_cell_length_c   4.920
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   41.189
_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
  Zr  Zr0  1  0.000  0.000  0.000  1.0
  Ti  Ti1  1  0.333  0.667  0.500  1.0
[/CIF]
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