The material structure described by LiVO2 is High Pressure (4-7GPa) Tellurium-derived structured and crystallizes in the triclinic P1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(3), one O(4), two equivalent O(1), and two equivalent O(2) atoms to form distorted LiO6 octahedra that share corners with two equivalent V(1)O6 octahedra, corners with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(2)O6 octahedra, edges with four equivalent V(1)O6 octahedra, and edges with four equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 7-22°. In the second Li site, Li(2) is bonded to one O(1), one O(2), two equivalent O(3), and two equivalent O(4) atoms to form distorted LiO6 octahedra that share corners with two equivalent V(2)O6 octahedra, corners with four equivalent Li(2)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, edges with four equivalent V(1)O6 octahedra, and edges with four equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 8-20°. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(3), one O(4), two equivalent O(1), and two equivalent O(2) atoms to form distorted VO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with four equivalent V(1)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(2)O6 octahedra, and edges with four equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 8-20°. In the second V site, V(2) is bonded to one O(1), one O(2), two equivalent O(3), and two equivalent O(4) atoms to form distorted VO6 octahedra that share corners with two equivalent Li(2)O6 octahedra, corners with four equivalent V(2)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(2)O6 octahedra, and edges with four equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 8-20°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Li(2), two equivalent Li(1), one V(2), and two equivalent V(1) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-22°. In the second O site, O(2) is bonded to one Li(2), two equivalent Li(1), one V(2), and two equivalent V(1) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-20°. In the third O site, O(3) is bonded to one Li(1), two equivalent Li(2), one V(1), and two equivalent V(2) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-20°. In the fourth O site, O(4) is bonded to one Li(1), two equivalent Li(2), one V(1), and two equivalent V(2) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-20°. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiVO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.100
_cell_length_b   4.200
_cell_length_c   5.279
_cell_angle_alpha   113.439
_cell_angle_beta   112.734
_cell_angle_gamma   90.051
_symmetry_Int_Tables_number   1
_cell_volume   75.617
_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  0.625  0.626  0.753  1.0
  Li  Li1  1  0.378  0.883  0.248  1.0
  V  V2  1  0.121  0.138  0.744  1.0
  V  V3  1  0.880  0.376  0.253  1.0
  O  O4  1  0.104  0.689  0.710  1.0
  O  O5  1  0.641  0.080  0.782  1.0
  O  O6  1  0.896  0.825  0.287  1.0
  O  O7  1  0.360  0.434  0.215  1.0
[/CIF]
.
The material structure described by LiVO2 is High Pressure (4-7GPa) Tellurium-derived structured and crystallizes in the triclinic P1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(3), one O(4), two equivalent O(1), and two equivalent O(2) atoms to form distorted LiO6 octahedra that share corners with two equivalent V(1)O6 octahedra, corners with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(2)O6 octahedra, edges with four equivalent V(1)O6 octahedra, and edges with four equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 7-22°. In the second Li site, Li(2) is bonded to one O(1), one O(2), two equivalent O(3), and two equivalent O(4) atoms to form distorted LiO6 octahedra that share corners with two equivalent V(2)O6 octahedra, corners with four equivalent Li(2)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, edges with four equivalent V(1)O6 octahedra, and edges with four equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 8-20°. There are two inequivalent V sites. In the first V site, V(1) is bonded to one O(3), one O(4), two equivalent O(1), and two equivalent O(2) atoms to form distorted VO6 octahedra that share corners with two equivalent Li(1)O6 octahedra, corners with four equivalent V(1)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(2)O6 octahedra, and edges with four equivalent V(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 8-20°. In the second V site, V(2) is bonded to one O(1), one O(2), two equivalent O(3), and two equivalent O(4) atoms to form distorted VO6 octahedra that share corners with two equivalent Li(2)O6 octahedra, corners with four equivalent V(2)O6 octahedra, edges with four equivalent Li(1)O6 octahedra, edges with four equivalent Li(2)O6 octahedra, and edges with four equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 8-20°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Li(2), two equivalent Li(1), one V(2), and two equivalent V(1) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-22°. In the second O site, O(2) is bonded to one Li(2), two equivalent Li(1), one V(2), and two equivalent V(1) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-20°. In the third O site, O(3) is bonded to one Li(1), two equivalent Li(2), one V(1), and two equivalent V(2) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-20°. In the fourth O site, O(4) is bonded to one Li(1), two equivalent Li(2), one V(1), and two equivalent V(2) atoms to form a mixture of distorted corner and edge-sharing OLi3V3 octahedra. The corner-sharing octahedral tilt angles range from 1-20°. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiVO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.100
_cell_length_b   4.200
_cell_length_c   5.279
_cell_angle_alpha   113.439
_cell_angle_beta   112.734
_cell_angle_gamma   90.051
_symmetry_Int_Tables_number   1
_cell_volume   75.617
_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  0.625  0.626  0.753  1.0
  Li  Li1  1  0.378  0.883  0.248  1.0
  V  V2  1  0.121  0.138  0.744  1.0
  V  V3  1  0.880  0.376  0.253  1.0
  O  O4  1  0.104  0.689  0.710  1.0
  O  O5  1  0.641  0.080  0.782  1.0
  O  O6  1  0.896  0.825  0.287  1.0
  O  O7  1  0.360  0.434  0.215  1.0
[/CIF]
.