The structure described by ScAsO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Sc(1) is bonded to twelve equivalent O(1) atoms to form ScO12 cuboctahedra that share corners with twelve equivalent Sc(1)O12 cuboctahedra, faces with six equivalent Sc(1)O12 cuboctahedra, and faces with eight equivalent As(1)O6 octahedra. As(1) is bonded to six equivalent O(1) atoms to form AsO6 octahedra that share corners with six equivalent As(1)O6 octahedra and faces with eight equivalent Sc(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. O(1) is bonded to four equivalent Sc(1) and two equivalent As(1) atoms to form a mixture of distorted edge, corner, and face-sharing OSc4As2 octahedra. The corner-sharing octahedral tilt angles range from 0-60°. is represented by the Crystallographic Information File (CIF) [CIF]
data_ScAsO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.942
_cell_length_b   3.942
_cell_length_c   3.942
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   61.257
_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
  Sc  Sc0  1  0.000  0.000  0.000  1.0
  As  As1  1  0.500  0.500  0.500  1.0
  O  O2  1  0.500  0.500  0.000  1.0
  O  O3  1  0.500  0.000  0.500  1.0
  O  O4  1  0.000  0.500  0.500  1.0
[/CIF]
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The structure described by ScAsO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Sc(1) is bonded to twelve equivalent O(1) atoms to form ScO12 cuboctahedra that share corners with twelve equivalent Sc(1)O12 cuboctahedra, faces with six equivalent Sc(1)O12 cuboctahedra, and faces with eight equivalent As(1)O6 octahedra. As(1) is bonded to six equivalent O(1) atoms to form AsO6 octahedra that share corners with six equivalent As(1)O6 octahedra and faces with eight equivalent Sc(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. O(1) is bonded to four equivalent Sc(1) and two equivalent As(1) atoms to form a mixture of distorted edge, corner, and face-sharing OSc4As2 octahedra. The corner-sharing octahedral tilt angles range from 0-60°. is represented by the Crystallographic Information File (CIF) [CIF]
data_ScAsO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.942
_cell_length_b   3.942
_cell_length_c   3.942
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   61.257
_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
  Sc  Sc0  1  0.000  0.000  0.000  1.0
  As  As1  1  0.500  0.500  0.500  1.0
  O  O2  1  0.500  0.500  0.000  1.0
  O  O3  1  0.500  0.000  0.500  1.0
  O  O4  1  0.000  0.500  0.500  1.0
[/CIF]
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