The material described by BiAlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Al(1) is bonded to six equivalent O(1) atoms to form AlO6 octahedra that share corners with six equivalent Al(1)O6 octahedra and faces with eight equivalent Bi(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. Bi(1) is bonded to twelve equivalent O(1) atoms to form BiO12 cuboctahedra that share corners with twelve equivalent Bi(1)O12 cuboctahedra, faces with six equivalent Bi(1)O12 cuboctahedra, and faces with eight equivalent Al(1)O6 octahedra. O(1) is bonded in a distorted linear geometry to two equivalent Al(1) and four equivalent Bi(1) atoms. is represented by the CIF card [CIF]
data_AlBiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.787
_cell_length_b   3.787
_cell_length_c   3.787
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   54.319
_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
  Al  Al0  1  0.500  0.500  0.500  1.0
  Bi  Bi1  1  0.000  0.000  0.000  1.0
  O  O2  1  0.500  0.000  0.500  1.0
  O  O3  1  0.500  0.500  0.000  1.0
  O  O4  1  0.000  0.500  0.500  1.0
[/CIF]
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The material described by BiAlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Al(1) is bonded to six equivalent O(1) atoms to form AlO6 octahedra that share corners with six equivalent Al(1)O6 octahedra and faces with eight equivalent Bi(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. Bi(1) is bonded to twelve equivalent O(1) atoms to form BiO12 cuboctahedra that share corners with twelve equivalent Bi(1)O12 cuboctahedra, faces with six equivalent Bi(1)O12 cuboctahedra, and faces with eight equivalent Al(1)O6 octahedra. O(1) is bonded in a distorted linear geometry to two equivalent Al(1) and four equivalent Bi(1) atoms. is represented by the CIF card [CIF]
data_AlBiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.787
_cell_length_b   3.787
_cell_length_c   3.787
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   54.319
_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
  Al  Al0  1  0.500  0.500  0.500  1.0
  Bi  Bi1  1  0.000  0.000  0.000  1.0
  O  O2  1  0.500  0.000  0.500  1.0
  O  O3  1  0.500  0.500  0.000  1.0
  O  O4  1  0.000  0.500  0.500  1.0
[/CIF]
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