The compound described by LiVTeO5 crystallizes in the orthorhombic Pnma space group. Li(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms to form distorted edge-sharing LiO6 octahedra. V(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one O(4), and two equivalent O(3) atoms. Te(1) is bonded in a distorted trigonal non-coplanar geometry to one O(4) and two equivalent O(3) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one V(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Li(1) and one V(1) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one Li(1), one V(1), and one Te(1) atom. In the fourth O site, O(4) is bonded to two equivalent Li(1), one V(1), and one Te(1) atom to form distorted corner-sharing OLi2VTe trigonal pyramids. is represented by the CIF card [CIF]
data_LiVTeO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.451
_cell_length_b   7.961
_cell_length_c   8.574
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   440.320
_cell_formula_units_Z   4
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  0.500  0.000  0.000  1.0
  Li  Li2  1  0.000  0.500  0.500  1.0
  Li  Li3  1  0.500  0.500  0.500  1.0
  V  V4  1  0.250  0.735  0.199  1.0
  V  V5  1  0.750  0.235  0.301  1.0
  V  V6  1  0.250  0.765  0.699  1.0
  V  V7  1  0.750  0.265  0.801  1.0
  Te  Te8  1  0.750  0.632  0.144  1.0
  Te  Te9  1  0.250  0.132  0.356  1.0
  Te  Te10  1  0.750  0.868  0.644  1.0
  Te  Te11  1  0.250  0.368  0.856  1.0
  O  O12  1  0.250  0.539  0.138  1.0
  O  O13  1  0.750  0.216  0.105  1.0
  O  O14  1  0.534  0.798  0.157  1.0
  O  O15  1  0.966  0.798  0.157  1.0
  O  O16  1  0.250  0.040  0.152  1.0
  O  O17  1  0.750  0.540  0.348  1.0
  O  O18  1  0.034  0.298  0.343  1.0
  O  O19  1  0.466  0.298  0.343  1.0
  O  O20  1  0.250  0.716  0.395  1.0
  O  O21  1  0.750  0.039  0.362  1.0
  O  O22  1  0.250  0.961  0.638  1.0
  O  O23  1  0.750  0.284  0.605  1.0
  O  O24  1  0.534  0.702  0.657  1.0
  O  O25  1  0.966  0.702  0.657  1.0
  O  O26  1  0.250  0.460  0.652  1.0
  O  O27  1  0.750  0.960  0.848  1.0
  O  O28  1  0.034  0.202  0.843  1.0
  O  O29  1  0.466  0.202  0.843  1.0
  O  O30  1  0.250  0.784  0.895  1.0
  O  O31  1  0.750  0.461  0.862  1.0
[/CIF]
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The compound described by LiVTeO5 crystallizes in the orthorhombic Pnma space group. Li(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms to form distorted edge-sharing LiO6 octahedra. V(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one O(4), and two equivalent O(3) atoms. Te(1) is bonded in a distorted trigonal non-coplanar geometry to one O(4) and two equivalent O(3) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one V(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Li(1) and one V(1) atom. In the third O site, O(3) is bonded in a trigonal planar geometry to one Li(1), one V(1), and one Te(1) atom. In the fourth O site, O(4) is bonded to two equivalent Li(1), one V(1), and one Te(1) atom to form distorted corner-sharing OLi2VTe trigonal pyramids. is represented by the CIF card [CIF]
data_LiVTeO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.451
_cell_length_b   7.961
_cell_length_c   8.574
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   440.320
_cell_formula_units_Z   4
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  0.500  0.000  0.000  1.0
  Li  Li2  1  0.000  0.500  0.500  1.0
  Li  Li3  1  0.500  0.500  0.500  1.0
  V  V4  1  0.250  0.735  0.199  1.0
  V  V5  1  0.750  0.235  0.301  1.0
  V  V6  1  0.250  0.765  0.699  1.0
  V  V7  1  0.750  0.265  0.801  1.0
  Te  Te8  1  0.750  0.632  0.144  1.0
  Te  Te9  1  0.250  0.132  0.356  1.0
  Te  Te10  1  0.750  0.868  0.644  1.0
  Te  Te11  1  0.250  0.368  0.856  1.0
  O  O12  1  0.250  0.539  0.138  1.0
  O  O13  1  0.750  0.216  0.105  1.0
  O  O14  1  0.534  0.798  0.157  1.0
  O  O15  1  0.966  0.798  0.157  1.0
  O  O16  1  0.250  0.040  0.152  1.0
  O  O17  1  0.750  0.540  0.348  1.0
  O  O18  1  0.034  0.298  0.343  1.0
  O  O19  1  0.466  0.298  0.343  1.0
  O  O20  1  0.250  0.716  0.395  1.0
  O  O21  1  0.750  0.039  0.362  1.0
  O  O22  1  0.250  0.961  0.638  1.0
  O  O23  1  0.750  0.284  0.605  1.0
  O  O24  1  0.534  0.702  0.657  1.0
  O  O25  1  0.966  0.702  0.657  1.0
  O  O26  1  0.250  0.460  0.652  1.0
  O  O27  1  0.750  0.960  0.848  1.0
  O  O28  1  0.034  0.202  0.843  1.0
  O  O29  1  0.466  0.202  0.843  1.0
  O  O30  1  0.250  0.784  0.895  1.0
  O  O31  1  0.750  0.461  0.862  1.0
[/CIF]
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