The material described by CdZnS2 is Enargite-like structured and crystallizes in the tetragonal P-4m2 space group. Cd(1) is bonded to four equivalent S(1) atoms to form CdS4 tetrahedra that share corners with four equivalent Cd(1)S4 tetrahedra and corners with eight equivalent Zn(1)S4 tetrahedra. Zn(1) is bonded to four equivalent S(1) atoms to form ZnS4 tetrahedra that share corners with four equivalent Zn(1)S4 tetrahedra and corners with eight equivalent Cd(1)S4 tetrahedra. S(1) is bonded to two equivalent Cd(1) and two equivalent Zn(1) atoms to form corner-sharing SZn2Cd2 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_ZnCdS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.954
_cell_length_b   3.954
_cell_length_c   5.719
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   89.429
_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
  Zn  Zn0  1  0.500  0.500  0.500  1.0
  Cd  Cd1  1  0.000  0.000  0.000  1.0
  S  S2  1  0.000  0.500  0.276  1.0
  S  S3  1  0.500  0.000  0.724  1.0
[/CIF]
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The material described by CdZnS2 is Enargite-like structured and crystallizes in the tetragonal P-4m2 space group. Cd(1) is bonded to four equivalent S(1) atoms to form CdS4 tetrahedra that share corners with four equivalent Cd(1)S4 tetrahedra and corners with eight equivalent Zn(1)S4 tetrahedra. Zn(1) is bonded to four equivalent S(1) atoms to form ZnS4 tetrahedra that share corners with four equivalent Zn(1)S4 tetrahedra and corners with eight equivalent Cd(1)S4 tetrahedra. S(1) is bonded to two equivalent Cd(1) and two equivalent Zn(1) atoms to form corner-sharing SZn2Cd2 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_ZnCdS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.954
_cell_length_b   3.954
_cell_length_c   5.719
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   89.429
_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
  Zn  Zn0  1  0.500  0.500  0.500  1.0
  Cd  Cd1  1  0.000  0.000  0.000  1.0
  S  S2  1  0.000  0.500  0.276  1.0
  S  S3  1  0.500  0.000  0.724  1.0
[/CIF]
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