The material structure described by ScGa3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. Sc(1) is bonded to twelve equivalent Ga(1) atoms to form ScGa12 cuboctahedra that share corners with twelve equivalent Sc(1)Ga12 cuboctahedra, edges with twenty-four equivalent Ga(1)Sc4Ga8 cuboctahedra, faces with six equivalent Sc(1)Ga12 cuboctahedra, and faces with twelve equivalent Ga(1)Sc4Ga8 cuboctahedra. Ga(1) is bonded to four equivalent Sc(1) and eight equivalent Ga(1) atoms to form distorted GaSc4Ga8 cuboctahedra that share corners with twelve equivalent Ga(1)Sc4Ga8 cuboctahedra, edges with eight equivalent Sc(1)Ga12 cuboctahedra, edges with sixteen equivalent Ga(1)Sc4Ga8 cuboctahedra, faces with four equivalent Sc(1)Ga12 cuboctahedra, and faces with fourteen equivalent Ga(1)Sc4Ga8 cuboctahedra. is represented by the CIF card [CIF]
data_ScGa3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.082
_cell_length_b   4.082
_cell_length_c   4.082
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   68.005
_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
  Ga  Ga1  1  0.500  0.500  0.000  1.0
  Ga  Ga2  1  0.500  0.000  0.500  1.0
  Ga  Ga3  1  0.000  0.500  0.500  1.0
[/CIF]
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The material structure described by ScGa3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. Sc(1) is bonded to twelve equivalent Ga(1) atoms to form ScGa12 cuboctahedra that share corners with twelve equivalent Sc(1)Ga12 cuboctahedra, edges with twenty-four equivalent Ga(1)Sc4Ga8 cuboctahedra, faces with six equivalent Sc(1)Ga12 cuboctahedra, and faces with twelve equivalent Ga(1)Sc4Ga8 cuboctahedra. Ga(1) is bonded to four equivalent Sc(1) and eight equivalent Ga(1) atoms to form distorted GaSc4Ga8 cuboctahedra that share corners with twelve equivalent Ga(1)Sc4Ga8 cuboctahedra, edges with eight equivalent Sc(1)Ga12 cuboctahedra, edges with sixteen equivalent Ga(1)Sc4Ga8 cuboctahedra, faces with four equivalent Sc(1)Ga12 cuboctahedra, and faces with fourteen equivalent Ga(1)Sc4Ga8 cuboctahedra. is represented by the CIF card [CIF]
data_ScGa3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.082
_cell_length_b   4.082
_cell_length_c   4.082
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   68.005
_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
  Ga  Ga1  1  0.500  0.500  0.000  1.0
  Ga  Ga2  1  0.500  0.000  0.500  1.0
  Ga  Ga3  1  0.000  0.500  0.500  1.0
[/CIF]
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