The crystal structure described by Ti2AlRe is Heusler structured and crystallizes in the cubic Fm-3m space group. Ti(1) is bonded in a body-centered cubic geometry to four equivalent Re(1) and four equivalent Al(1) atoms. Re(1) is bonded in a distorted body-centered cubic geometry to eight equivalent Ti(1) and six equivalent Al(1) atoms. Al(1) is bonded in a distorted body-centered cubic geometry to eight equivalent Ti(1) and six equivalent Re(1) atoms. is represented by the CIF card [CIF]
data_Ti2AlRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.434
_cell_length_b   4.434
_cell_length_c   4.434
_cell_angle_alpha   59.996
_cell_angle_beta   59.994
_cell_angle_gamma   59.997
_symmetry_Int_Tables_number   1
_cell_volume   61.641
_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
  Ti  Ti1  1  0.500  0.500  0.500  1.0
  Al  Al2  1  0.250  0.250  0.250  1.0
  Re  Re3  1  0.750  0.750  0.750  1.0
[/CIF]
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The crystal structure described by Ti2AlRe is Heusler structured and crystallizes in the cubic Fm-3m space group. Ti(1) is bonded in a body-centered cubic geometry to four equivalent Re(1) and four equivalent Al(1) atoms. Re(1) is bonded in a distorted body-centered cubic geometry to eight equivalent Ti(1) and six equivalent Al(1) atoms. Al(1) is bonded in a distorted body-centered cubic geometry to eight equivalent Ti(1) and six equivalent Re(1) atoms. is represented by the CIF card [CIF]
data_Ti2AlRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.434
_cell_length_b   4.434
_cell_length_c   4.434
_cell_angle_alpha   59.996
_cell_angle_beta   59.994
_cell_angle_gamma   59.997
_symmetry_Int_Tables_number   1
_cell_volume   61.641
_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
  Ti  Ti1  1  0.500  0.500  0.500  1.0
  Al  Al2  1  0.250  0.250  0.250  1.0
  Re  Re3  1  0.750  0.750  0.750  1.0
[/CIF]
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