The compound described by Li2TiV3O8 is Spinel-derived structured and crystallizes in the triclinic P-1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(4), one O(5), and one O(7) atom to form LiO4 tetrahedra that share corners with three equivalent Ti(1)O6 octahedra, corners with three equivalent V(1)O6 octahedra, corners with three equivalent V(3)O6 octahedra, and corners with three equivalent V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 54-62°. In the second Li site, Li(2) is bonded to one O(2), one O(3), one O(6), and one O(8) atom to form LiO4 tetrahedra that share corners with three equivalent Ti(1)O6 octahedra, corners with three equivalent V(1)O6 octahedra, corners with three equivalent V(2)O6 octahedra, and corners with three equivalent V(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 55-62°. Ti(1) is bonded to one O(3), one O(4), one O(5), one O(6), one O(7), and one O(8) atom to form TiO6 octahedra that share corners with three equivalent Li(1)O4 tetrahedra, corners with three equivalent Li(2)O4 tetrahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra, edges with two equivalent V(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(7), and one O(8) atom to form VO6 octahedra that share corners with three equivalent Li(1)O4 tetrahedra, corners with three equivalent Li(2)O4 tetrahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra, edges with two equivalent Ti(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. In the second V site, V(2) is bonded to two equivalent O(2), two equivalent O(6), and two equivalent O(8) atoms to form VO6 octahedra that share corners with six equivalent Li(2)O4 tetrahedra, edges with two equivalent Ti(1)O6 octahedra, edges with two equivalent V(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. In the third V site, V(3) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form VO6 octahedra that share corners with three equivalent Li(1)O4 tetrahedra, corners with three equivalent Li(2)O4 tetrahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra, edges with two equivalent Ti(1)O6 octahedra, and edges with two equivalent V(1)O6 octahedra. In the fourth V site, V(4) is bonded to two equivalent O(1), two equivalent O(5), and two equivalent O(7) atoms to form VO6 octahedra that share corners with six equivalent Li(1)O4 tetrahedra, edges with two equivalent Ti(1)O6 octahedra, edges with two equivalent V(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. There are eight inequivalent O sites. In the first O site, O(1) is bonded to one Li(1), one V(1), one V(3), and one V(4) atom to form distorted OLiV3 tetrahedra that share  a cornercorner with one O(1)LiV3 tetrahedra,  a cornercorner with one O(6)LiTiV2 trigonal pyramid, and  an edgeedge with one O(3)LiTiV2 trigonal pyramid. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Li(2), one V(1), one V(2), and one V(3) atom. In the third O site, O(3) is bonded to one Li(2), one Ti(1), one V(1), and one V(3) atom to form distorted OLiTiV2 trigonal pyramids that share corners with three equivalent O(6)LiTiV2 trigonal pyramids and  an edgeedge with one O(1)LiV3 tetrahedra. In the fourth O site, O(4) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Ti(1), one V(1), and one V(3) atom. In the fifth O site, O(5) is bonded in a rectangular see-saw-like geometry to one Li(1), one Ti(1), one V(3), and one V(4) atom. In the sixth O site, O(6) is bonded to one Li(2), one Ti(1), one V(2), and one V(3) atom to form distorted OLiTiV2 trigonal pyramids that share  a cornercorner with one O(1)LiV3 tetrahedra,  a cornercorner with one O(6)LiTiV2 trigonal pyramid, and corners with three equivalent O(3)LiTiV2 trigonal pyramids. In the seventh O site, O(7) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Ti(1), one V(1), and one V(4) atom. In the eighth O site, O(8) is bonded in a distorted rectangular see-saw-like geometry to one Li(2), one Ti(1), one V(1), and one V(2) atom. is represented by the CIF card [CIF]
data_Li2TiV3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.934
_cell_length_b   5.990
_cell_length_c   5.996
_cell_angle_alpha   119.405
_cell_angle_beta   90.884
_cell_angle_gamma   119.225
_symmetry_Int_Tables_number   1
_cell_volume   152.637
_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
  Li  Li0  1  0.882  0.263  0.125  1.0
  Li  Li1  1  0.118  0.737  0.875  1.0
  O  O2  1  0.746  0.536  0.269  1.0
  O  O3  1  0.254  0.464  0.731  1.0
  O  O4  1  0.743  0.986  0.713  1.0
  O  O5  1  0.291  0.540  0.266  1.0
  O  O6  1  0.751  0.991  0.275  1.0
  O  O7  1  0.249  0.009  0.725  1.0
  O  O8  1  0.709  0.460  0.734  1.0
  O  O9  1  0.257  0.014  0.287  1.0
  Ti  Ti10  1  0.500  0.000  0.500  1.0
  V  V11  1  0.000  0.000  0.500  1.0
  V  V12  1  0.500  0.500  0.000  1.0
  V  V13  1  0.500  0.500  0.500  1.0
[/CIF]
.
The compound described by Li2TiV3O8 is Spinel-derived structured and crystallizes in the triclinic P-1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded to one O(1), one O(4), one O(5), and one O(7) atom to form LiO4 tetrahedra that share corners with three equivalent Ti(1)O6 octahedra, corners with three equivalent V(1)O6 octahedra, corners with three equivalent V(3)O6 octahedra, and corners with three equivalent V(4)O6 octahedra. The corner-sharing octahedral tilt angles range from 54-62°. In the second Li site, Li(2) is bonded to one O(2), one O(3), one O(6), and one O(8) atom to form LiO4 tetrahedra that share corners with three equivalent Ti(1)O6 octahedra, corners with three equivalent V(1)O6 octahedra, corners with three equivalent V(2)O6 octahedra, and corners with three equivalent V(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 55-62°. Ti(1) is bonded to one O(3), one O(4), one O(5), one O(6), one O(7), and one O(8) atom to form TiO6 octahedra that share corners with three equivalent Li(1)O4 tetrahedra, corners with three equivalent Li(2)O4 tetrahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra, edges with two equivalent V(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. There are four inequivalent V sites. In the first V site, V(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(7), and one O(8) atom to form VO6 octahedra that share corners with three equivalent Li(1)O4 tetrahedra, corners with three equivalent Li(2)O4 tetrahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra, edges with two equivalent Ti(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. In the second V site, V(2) is bonded to two equivalent O(2), two equivalent O(6), and two equivalent O(8) atoms to form VO6 octahedra that share corners with six equivalent Li(2)O4 tetrahedra, edges with two equivalent Ti(1)O6 octahedra, edges with two equivalent V(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. In the third V site, V(3) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form VO6 octahedra that share corners with three equivalent Li(1)O4 tetrahedra, corners with three equivalent Li(2)O4 tetrahedra,  an edgeedge with one V(2)O6 octahedra,  an edgeedge with one V(4)O6 octahedra, edges with two equivalent Ti(1)O6 octahedra, and edges with two equivalent V(1)O6 octahedra. In the fourth V site, V(4) is bonded to two equivalent O(1), two equivalent O(5), and two equivalent O(7) atoms to form VO6 octahedra that share corners with six equivalent Li(1)O4 tetrahedra, edges with two equivalent Ti(1)O6 octahedra, edges with two equivalent V(1)O6 octahedra, and edges with two equivalent V(3)O6 octahedra. There are eight inequivalent O sites. In the first O site, O(1) is bonded to one Li(1), one V(1), one V(3), and one V(4) atom to form distorted OLiV3 tetrahedra that share  a cornercorner with one O(1)LiV3 tetrahedra,  a cornercorner with one O(6)LiTiV2 trigonal pyramid, and  an edgeedge with one O(3)LiTiV2 trigonal pyramid. In the second O site, O(2) is bonded in a rectangular see-saw-like geometry to one Li(2), one V(1), one V(2), and one V(3) atom. In the third O site, O(3) is bonded to one Li(2), one Ti(1), one V(1), and one V(3) atom to form distorted OLiTiV2 trigonal pyramids that share corners with three equivalent O(6)LiTiV2 trigonal pyramids and  an edgeedge with one O(1)LiV3 tetrahedra. In the fourth O site, O(4) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Ti(1), one V(1), and one V(3) atom. In the fifth O site, O(5) is bonded in a rectangular see-saw-like geometry to one Li(1), one Ti(1), one V(3), and one V(4) atom. In the sixth O site, O(6) is bonded to one Li(2), one Ti(1), one V(2), and one V(3) atom to form distorted OLiTiV2 trigonal pyramids that share  a cornercorner with one O(1)LiV3 tetrahedra,  a cornercorner with one O(6)LiTiV2 trigonal pyramid, and corners with three equivalent O(3)LiTiV2 trigonal pyramids. In the seventh O site, O(7) is bonded in a distorted rectangular see-saw-like geometry to one Li(1), one Ti(1), one V(1), and one V(4) atom. In the eighth O site, O(8) is bonded in a distorted rectangular see-saw-like geometry to one Li(2), one Ti(1), one V(1), and one V(2) atom. is represented by the CIF card [CIF]
data_Li2TiV3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.934
_cell_length_b   5.990
_cell_length_c   5.996
_cell_angle_alpha   119.405
_cell_angle_beta   90.884
_cell_angle_gamma   119.225
_symmetry_Int_Tables_number   1
_cell_volume   152.637
_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
  Li  Li0  1  0.882  0.263  0.125  1.0
  Li  Li1  1  0.118  0.737  0.875  1.0
  O  O2  1  0.746  0.536  0.269  1.0
  O  O3  1  0.254  0.464  0.731  1.0
  O  O4  1  0.743  0.986  0.713  1.0
  O  O5  1  0.291  0.540  0.266  1.0
  O  O6  1  0.751  0.991  0.275  1.0
  O  O7  1  0.249  0.009  0.725  1.0
  O  O8  1  0.709  0.460  0.734  1.0
  O  O9  1  0.257  0.014  0.287  1.0
  Ti  Ti10  1  0.500  0.000  0.500  1.0
  V  V11  1  0.000  0.000  0.500  1.0
  V  V12  1  0.500  0.500  0.000  1.0
  V  V13  1  0.500  0.500  0.500  1.0
[/CIF]
.