The structure described by CeScSi crystallizes in the tetragonal I4/mmm space group. Ce(1) is bonded in a 5-coordinate geometry to five equivalent Si(1) atoms. Sc(1) is bonded in a distorted square co-planar geometry to four equivalent Si(1) atoms. Si(1) is bonded in a 9-coordinate geometry to five equivalent Ce(1) and four equivalent Sc(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_CeScSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.487
_cell_length_b   8.487
_cell_length_c   8.487
_cell_angle_alpha   151.067
_cell_angle_beta   151.067
_cell_angle_gamma   41.377
_symmetry_Int_Tables_number   1
_cell_volume   142.743
_cell_formula_units_Z   2
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
  Ce  Ce0  1  0.679  0.679  0.000  1.0
  Ce  Ce1  1  0.321  0.321  0.000  1.0
  Sc  Sc2  1  0.000  0.500  0.500  1.0
  Sc  Sc3  1  0.500  0.000  0.500  1.0
  Si  Si4  1  0.877  0.877  0.000  1.0
  Si  Si5  1  0.123  0.123  0.000  1.0
[/CIF]
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The structure described by CeScSi crystallizes in the tetragonal I4/mmm space group. Ce(1) is bonded in a 5-coordinate geometry to five equivalent Si(1) atoms. Sc(1) is bonded in a distorted square co-planar geometry to four equivalent Si(1) atoms. Si(1) is bonded in a 9-coordinate geometry to five equivalent Ce(1) and four equivalent Sc(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_CeScSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.487
_cell_length_b   8.487
_cell_length_c   8.487
_cell_angle_alpha   151.067
_cell_angle_beta   151.067
_cell_angle_gamma   41.377
_symmetry_Int_Tables_number   1
_cell_volume   142.743
_cell_formula_units_Z   2
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
  Ce  Ce0  1  0.679  0.679  0.000  1.0
  Ce  Ce1  1  0.321  0.321  0.000  1.0
  Sc  Sc2  1  0.000  0.500  0.500  1.0
  Sc  Sc3  1  0.500  0.000  0.500  1.0
  Si  Si4  1  0.877  0.877  0.000  1.0
  Si  Si5  1  0.123  0.123  0.000  1.0
[/CIF]
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