The material described by NdScSi crystallizes in the tetragonal I4/mmm space group. Nd(1) is bonded in a 9-coordinate geometry to five equivalent Sc(1) and four equivalent Si(1) atoms. Sc(1) is bonded in a 4-coordinate geometry to five equivalent Nd(1) and four equivalent Si(1) atoms. Si(1) is bonded in a body-centered cubic geometry to four equivalent Nd(1) and four equivalent Sc(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_NdScSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.653
_cell_length_b   4.653
_cell_length_c   7.803
_cell_angle_alpha   107.346
_cell_angle_beta   107.346
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   153.155
_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
  Nd  Nd0  1  0.141  0.141  0.282  1.0
  Nd  Nd1  1  0.859  0.859  0.718  1.0
  Sc  Sc2  1  0.389  0.389  0.778  1.0
  Sc  Sc3  1  0.611  0.611  0.222  1.0
  Si  Si4  1  0.000  0.500  0.000  1.0
  Si  Si5  1  0.500  0.000  0.000  1.0
[/CIF]
.
The material described by NdScSi crystallizes in the tetragonal I4/mmm space group. Nd(1) is bonded in a 9-coordinate geometry to five equivalent Sc(1) and four equivalent Si(1) atoms. Sc(1) is bonded in a 4-coordinate geometry to five equivalent Nd(1) and four equivalent Si(1) atoms. Si(1) is bonded in a body-centered cubic geometry to four equivalent Nd(1) and four equivalent Sc(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_NdScSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.653
_cell_length_b   4.653
_cell_length_c   7.803
_cell_angle_alpha   107.346
_cell_angle_beta   107.346
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   153.155
_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
  Nd  Nd0  1  0.141  0.141  0.282  1.0
  Nd  Nd1  1  0.859  0.859  0.718  1.0
  Sc  Sc2  1  0.389  0.389  0.778  1.0
  Sc  Sc3  1  0.611  0.611  0.222  1.0
  Si  Si4  1  0.000  0.500  0.000  1.0
  Si  Si5  1  0.500  0.000  0.000  1.0
[/CIF]
.