The compound described by LiZnVO4 crystallizes in the trigonal R3 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(2), one O(5), and one O(8) atom to form LiO4 tetrahedra that share corners with two equivalent V(1)O4 tetrahedra, corners with two equivalent V(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. In the second Li site, Li(2) is bonded to one O(3), one O(4), one O(6), and one O(7) atom to form LiO4 tetrahedra that share corners with two equivalent V(1)O4 tetrahedra, corners with two equivalent V(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(3), one O(5), and one O(7) atom to form VO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. In the second V site, V(2) is bonded to one O(2), one O(4), one O(6), and one O(8) atom to form VO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to one O(1), one O(2), one O(6), and one O(7) atom to form ZnO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent V(1)O4 tetrahedra, and corners with two equivalent V(2)O4 tetrahedra. In the second Zn site, Zn(2) is bonded to one O(3), one O(4), one O(5), and one O(8) atom to form ZnO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent V(1)O4 tetrahedra, and corners with two equivalent V(2)O4 tetrahedra. There are eight inequivalent O sites. In the first O site, O(5) is bonded in a trigonal planar geometry to one Li(1), one V(1), and one Zn(2) atom. In the second O site, O(6) is bonded in a trigonal planar geometry to one Li(2), one V(2), and one Zn(1) atom. In the third O site, O(7) is bonded in a trigonal planar geometry to one Li(2), one V(1), and one Zn(1) atom. In the fourth O site, O(8) is bonded in a trigonal planar geometry to one Li(1), one V(2), and one Zn(2) atom. In the fifth O site, O(1) is bonded in a trigonal planar geometry to one Li(1), one V(1), and one Zn(1) atom. In the sixth O site, O(2) is bonded in a trigonal planar geometry to one Li(1), one V(2), and one Zn(1) atom. In the seventh O site, O(3) is bonded in a trigonal planar geometry to one Li(2), one V(1), and one Zn(2) atom. In the eighth O site, O(4) is bonded in a trigonal planar geometry to one Li(2), one V(2), and one Zn(2) atom. is represented by the CIF card [CIF]
data_LiVZnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.908
_cell_length_b   8.908
_cell_length_c   8.908
_cell_angle_alpha   107.826
_cell_angle_beta   107.826
_cell_angle_gamma   107.826
_symmetry_Int_Tables_number   1
_cell_volume   574.937
_cell_formula_units_Z   6
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  0.204  0.439  0.611  1.0
  Li  Li1  1  0.439  0.611  0.204  1.0
  Li  Li2  1  0.611  0.204  0.439  1.0
  Li  Li3  1  0.896  0.724  0.126  1.0
  Li  Li4  1  0.724  0.126  0.896  1.0
  Li  Li5  1  0.126  0.896  0.724  1.0
  V  V6  1  0.538  0.767  0.945  1.0
  V  V7  1  0.767  0.945  0.538  1.0
  V  V8  1  0.945  0.538  0.767  1.0
  V  V9  1  0.462  0.233  0.054  1.0
  V  V10  1  0.233  0.054  0.462  1.0
  V  V11  1  0.054  0.462  0.233  1.0
  Zn  Zn12  1  0.796  0.562  0.389  1.0
  Zn  Zn13  1  0.562  0.389  0.796  1.0
  Zn  Zn14  1  0.389  0.796  0.562  1.0
  Zn  Zn15  1  0.105  0.275  0.873  1.0
  Zn  Zn16  1  0.275  0.873  0.105  1.0
  Zn  Zn17  1  0.873  0.105  0.275  1.0
  O  O18  1  0.390  0.687  0.725  1.0
  O  O19  1  0.687  0.725  0.390  1.0
  O  O20  1  0.725  0.390  0.687  1.0
  O  O21  1  0.612  0.316  0.275  1.0
  O  O22  1  0.316  0.275  0.612  1.0
  O  O23  1  0.275  0.612  0.316  1.0
  O  O24  1  0.695  0.984  0.028  1.0
  O  O25  1  0.984  0.028  0.695  1.0
  O  O26  1  0.028  0.695  0.984  1.0
  O  O27  1  0.306  0.017  0.974  1.0
  O  O28  1  0.017  0.974  0.306  1.0
  O  O29  1  0.974  0.306  0.017  1.0
  O  O30  1  0.425  0.754  0.074  1.0
  O  O31  1  0.754  0.074  0.425  1.0
  O  O32  1  0.074  0.425  0.754  1.0
  O  O33  1  0.575  0.246  0.926  1.0
  O  O34  1  0.246  0.926  0.575  1.0
  O  O35  1  0.926  0.575  0.246  1.0
  O  O36  1  0.647  0.635  0.962  1.0
  O  O37  1  0.635  0.962  0.647  1.0
  O  O38  1  0.962  0.647  0.635  1.0
  O  O39  1  0.351  0.363  0.036  1.0
  O  O40  1  0.363  0.036  0.351  1.0
  O  O41  1  0.036  0.351  0.363  1.0
[/CIF]
.
The compound described by LiZnVO4 crystallizes in the trigonal R3 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(2), one O(5), and one O(8) atom to form LiO4 tetrahedra that share corners with two equivalent V(1)O4 tetrahedra, corners with two equivalent V(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. In the second Li site, Li(2) is bonded to one O(3), one O(4), one O(6), and one O(7) atom to form LiO4 tetrahedra that share corners with two equivalent V(1)O4 tetrahedra, corners with two equivalent V(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(3), one O(5), and one O(7) atom to form VO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. In the second V site, V(2) is bonded to one O(2), one O(4), one O(6), and one O(8) atom to form VO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent Zn(1)O4 tetrahedra, and corners with two equivalent Zn(2)O4 tetrahedra. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded to one O(1), one O(2), one O(6), and one O(7) atom to form ZnO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent V(1)O4 tetrahedra, and corners with two equivalent V(2)O4 tetrahedra. In the second Zn site, Zn(2) is bonded to one O(3), one O(4), one O(5), and one O(8) atom to form ZnO4 tetrahedra that share corners with two equivalent Li(1)O4 tetrahedra, corners with two equivalent Li(2)O4 tetrahedra, corners with two equivalent V(1)O4 tetrahedra, and corners with two equivalent V(2)O4 tetrahedra. There are eight inequivalent O sites. In the first O site, O(5) is bonded in a trigonal planar geometry to one Li(1), one V(1), and one Zn(2) atom. In the second O site, O(6) is bonded in a trigonal planar geometry to one Li(2), one V(2), and one Zn(1) atom. In the third O site, O(7) is bonded in a trigonal planar geometry to one Li(2), one V(1), and one Zn(1) atom. In the fourth O site, O(8) is bonded in a trigonal planar geometry to one Li(1), one V(2), and one Zn(2) atom. In the fifth O site, O(1) is bonded in a trigonal planar geometry to one Li(1), one V(1), and one Zn(1) atom. In the sixth O site, O(2) is bonded in a trigonal planar geometry to one Li(1), one V(2), and one Zn(1) atom. In the seventh O site, O(3) is bonded in a trigonal planar geometry to one Li(2), one V(1), and one Zn(2) atom. In the eighth O site, O(4) is bonded in a trigonal planar geometry to one Li(2), one V(2), and one Zn(2) atom. is represented by the CIF card [CIF]
data_LiVZnO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.908
_cell_length_b   8.908
_cell_length_c   8.908
_cell_angle_alpha   107.826
_cell_angle_beta   107.826
_cell_angle_gamma   107.826
_symmetry_Int_Tables_number   1
_cell_volume   574.937
_cell_formula_units_Z   6
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  0.204  0.439  0.611  1.0
  Li  Li1  1  0.439  0.611  0.204  1.0
  Li  Li2  1  0.611  0.204  0.439  1.0
  Li  Li3  1  0.896  0.724  0.126  1.0
  Li  Li4  1  0.724  0.126  0.896  1.0
  Li  Li5  1  0.126  0.896  0.724  1.0
  V  V6  1  0.538  0.767  0.945  1.0
  V  V7  1  0.767  0.945  0.538  1.0
  V  V8  1  0.945  0.538  0.767  1.0
  V  V9  1  0.462  0.233  0.054  1.0
  V  V10  1  0.233  0.054  0.462  1.0
  V  V11  1  0.054  0.462  0.233  1.0
  Zn  Zn12  1  0.796  0.562  0.389  1.0
  Zn  Zn13  1  0.562  0.389  0.796  1.0
  Zn  Zn14  1  0.389  0.796  0.562  1.0
  Zn  Zn15  1  0.105  0.275  0.873  1.0
  Zn  Zn16  1  0.275  0.873  0.105  1.0
  Zn  Zn17  1  0.873  0.105  0.275  1.0
  O  O18  1  0.390  0.687  0.725  1.0
  O  O19  1  0.687  0.725  0.390  1.0
  O  O20  1  0.725  0.390  0.687  1.0
  O  O21  1  0.612  0.316  0.275  1.0
  O  O22  1  0.316  0.275  0.612  1.0
  O  O23  1  0.275  0.612  0.316  1.0
  O  O24  1  0.695  0.984  0.028  1.0
  O  O25  1  0.984  0.028  0.695  1.0
  O  O26  1  0.028  0.695  0.984  1.0
  O  O27  1  0.306  0.017  0.974  1.0
  O  O28  1  0.017  0.974  0.306  1.0
  O  O29  1  0.974  0.306  0.017  1.0
  O  O30  1  0.425  0.754  0.074  1.0
  O  O31  1  0.754  0.074  0.425  1.0
  O  O32  1  0.074  0.425  0.754  1.0
  O  O33  1  0.575  0.246  0.926  1.0
  O  O34  1  0.246  0.926  0.575  1.0
  O  O35  1  0.926  0.575  0.246  1.0
  O  O36  1  0.647  0.635  0.962  1.0
  O  O37  1  0.635  0.962  0.647  1.0
  O  O38  1  0.962  0.647  0.635  1.0
  O  O39  1  0.351  0.363  0.036  1.0
  O  O40  1  0.363  0.036  0.351  1.0
  O  O41  1  0.036  0.351  0.363  1.0
[/CIF]
.