The material described by SrLiSb is half-Heusler structured and crystallizes in the cubic F-43m space group. Li(1) is bonded to four equivalent Sr(1) atoms to form LiSr4 tetrahedra that share corners with four equivalent Sb(1)Sr4 tetrahedra, corners with twelve equivalent Li(1)Sr4 tetrahedra, and edges with six equivalent Sb(1)Sr4 tetrahedra. Sr(1) is bonded in a distorted body-centered cubic geometry to four equivalent Li(1) and four equivalent Sb(1) atoms. Sb(1) is bonded to four equivalent Sr(1) atoms to form SbSr4 tetrahedra that share corners with four equivalent Li(1)Sr4 tetrahedra, corners with twelve equivalent Sb(1)Sr4 tetrahedra, and edges with six equivalent Li(1)Sr4 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_SrLiSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.306
_cell_length_b   5.306
_cell_length_c   5.306
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   105.648
_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
  Sr  Sr0  1  0.250  0.250  0.250  1.0
  Li  Li1  1  0.000  0.000  0.000  1.0
  Sb  Sb2  1  0.500  0.500  0.500  1.0
[/CIF]
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The material described by SrLiSb is half-Heusler structured and crystallizes in the cubic F-43m space group. Li(1) is bonded to four equivalent Sr(1) atoms to form LiSr4 tetrahedra that share corners with four equivalent Sb(1)Sr4 tetrahedra, corners with twelve equivalent Li(1)Sr4 tetrahedra, and edges with six equivalent Sb(1)Sr4 tetrahedra. Sr(1) is bonded in a distorted body-centered cubic geometry to four equivalent Li(1) and four equivalent Sb(1) atoms. Sb(1) is bonded to four equivalent Sr(1) atoms to form SbSr4 tetrahedra that share corners with four equivalent Li(1)Sr4 tetrahedra, corners with twelve equivalent Sb(1)Sr4 tetrahedra, and edges with six equivalent Li(1)Sr4 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_SrLiSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.306
_cell_length_b   5.306
_cell_length_c   5.306
_cell_angle_alpha   60.000
_cell_angle_beta   60.000
_cell_angle_gamma   60.000
_symmetry_Int_Tables_number   1
_cell_volume   105.648
_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
  Sr  Sr0  1  0.250  0.250  0.250  1.0
  Li  Li1  1  0.000  0.000  0.000  1.0
  Sb  Sb2  1  0.500  0.500  0.500  1.0
[/CIF]
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