The compound described by LiZnO2 is Caswellsilverite-like structured and crystallizes in the tetragonal I4_1/amd space group. Li(1) is bonded to six O(1,1,1,1) atoms to form LiO6 octahedra that share corners with two equivalent Zn(1)O6 octahedra, corners with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, and edges with eight equivalent Zn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. Zn(1) is bonded to six O(1,1,1,1) atoms to form ZnO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with four equivalent Zn(1)O6 octahedra, edges with four equivalent Zn(1)O6 octahedra, and edges with eight equivalent Li(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. There are five inequivalent O sites. In the first O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the second O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the third O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the fourth O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the fifth O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiZnO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.211
_cell_length_b   5.211
_cell_length_c   5.211
_cell_angle_alpha   132.574
_cell_angle_beta   132.574
_cell_angle_gamma   69.325
_symmetry_Int_Tables_number   1
_cell_volume   75.284
_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
  Li  Li0  1  0.000  0.000  0.000  1.0
  Li  Li1  1  0.750  0.250  0.500  1.0
  Zn  Zn2  1  0.500  0.500  0.000  1.0
  Zn  Zn3  1  0.250  0.750  0.500  1.0
  O  O4  1  0.483  0.983  0.500  1.0
  O  O5  1  0.267  0.267  0.000  1.0
  O  O6  1  0.733  0.733  0.000  1.0
  O  O7  1  0.017  0.517  0.500  1.0
[/CIF]
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The compound described by LiZnO2 is Caswellsilverite-like structured and crystallizes in the tetragonal I4_1/amd space group. Li(1) is bonded to six O(1,1,1,1) atoms to form LiO6 octahedra that share corners with two equivalent Zn(1)O6 octahedra, corners with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, and edges with eight equivalent Zn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. Zn(1) is bonded to six O(1,1,1,1) atoms to form ZnO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with four equivalent Zn(1)O6 octahedra, edges with four equivalent Zn(1)O6 octahedra, and edges with eight equivalent Li(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. There are five inequivalent O sites. In the first O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the second O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the third O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the fourth O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. In the fifth O site, O(1) is bonded to three equivalent Li(1) and three equivalent Zn(1) atoms to form a mixture of corner and edge-sharing OLi3Zn3 octahedra. The corner-sharing octahedral tilt angles range from 0-8°. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiZnO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.211
_cell_length_b   5.211
_cell_length_c   5.211
_cell_angle_alpha   132.574
_cell_angle_beta   132.574
_cell_angle_gamma   69.325
_symmetry_Int_Tables_number   1
_cell_volume   75.284
_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
  Li  Li0  1  0.000  0.000  0.000  1.0
  Li  Li1  1  0.750  0.250  0.500  1.0
  Zn  Zn2  1  0.500  0.500  0.000  1.0
  Zn  Zn3  1  0.250  0.750  0.500  1.0
  O  O4  1  0.483  0.983  0.500  1.0
  O  O5  1  0.267  0.267  0.000  1.0
  O  O6  1  0.733  0.733  0.000  1.0
  O  O7  1  0.017  0.517  0.500  1.0
[/CIF]
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