The structure described by Li2VBO4 is beta beryllia-derived structured and crystallizes in the orthorhombic Pmn2_1 space group. Li(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form LiO4 tetrahedra that share corners with four equivalent Li(1)O4 tetrahedra, corners with four equivalent V(1)O4 tetrahedra, and corners with four equivalent B(1)O4 tetrahedra. V(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form VO4 tetrahedra that share corners with four equivalent B(1)O4 tetrahedra and corners with eight equivalent Li(1)O4 tetrahedra. B(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form BO4 tetrahedra that share corners with four equivalent V(1)O4 tetrahedra and corners with eight equivalent Li(1)O4 tetrahedra. There are three inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Li(1), one V(1), and one B(1) atom to form corner-sharing OLi2VB tetrahedra. In the second O site, O(2) is bonded in a distorted rectangular see-saw-like geometry to two equivalent Li(1), one V(1), and one B(1) atom. In the third O site, O(3) is bonded to two equivalent Li(1), one V(1), and one B(1) atom to form distorted corner-sharing OLi2VB tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li2VBO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.718
_cell_length_b   5.447
_cell_length_c   5.869
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   150.830
_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
  B  B0  1  0.496  0.823  0.000  1.0
  B  B1  1  0.996  0.177  0.500  1.0
  Li  Li2  1  0.010  0.658  0.746  1.0
  Li  Li3  1  0.510  0.342  0.754  1.0
  Li  Li4  1  0.010  0.658  0.254  1.0
  Li  Li5  1  0.510  0.342  0.246  1.0
  O  O6  1  0.180  0.819  0.000  1.0
  O  O7  1  0.680  0.181  0.500  1.0
  O  O8  1  0.593  0.089  0.000  1.0
  O  O9  1  0.093  0.911  0.500  1.0
  O  O10  1  0.097  0.307  0.711  1.0
  O  O11  1  0.597  0.693  0.789  1.0
  O  O12  1  0.597  0.693  0.211  1.0
  O  O13  1  0.097  0.307  0.289  1.0
  V  V14  1  0.017  0.136  1.000  1.0
  V  V15  1  0.517  0.864  0.500  1.0
[/CIF]
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The structure described by Li2VBO4 is beta beryllia-derived structured and crystallizes in the orthorhombic Pmn2_1 space group. Li(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form LiO4 tetrahedra that share corners with four equivalent Li(1)O4 tetrahedra, corners with four equivalent V(1)O4 tetrahedra, and corners with four equivalent B(1)O4 tetrahedra. V(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form VO4 tetrahedra that share corners with four equivalent B(1)O4 tetrahedra and corners with eight equivalent Li(1)O4 tetrahedra. B(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form BO4 tetrahedra that share corners with four equivalent V(1)O4 tetrahedra and corners with eight equivalent Li(1)O4 tetrahedra. There are three inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Li(1), one V(1), and one B(1) atom to form corner-sharing OLi2VB tetrahedra. In the second O site, O(2) is bonded in a distorted rectangular see-saw-like geometry to two equivalent Li(1), one V(1), and one B(1) atom. In the third O site, O(3) is bonded to two equivalent Li(1), one V(1), and one B(1) atom to form distorted corner-sharing OLi2VB tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li2VBO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.718
_cell_length_b   5.447
_cell_length_c   5.869
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   150.830
_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
  B  B0  1  0.496  0.823  0.000  1.0
  B  B1  1  0.996  0.177  0.500  1.0
  Li  Li2  1  0.010  0.658  0.746  1.0
  Li  Li3  1  0.510  0.342  0.754  1.0
  Li  Li4  1  0.010  0.658  0.254  1.0
  Li  Li5  1  0.510  0.342  0.246  1.0
  O  O6  1  0.180  0.819  0.000  1.0
  O  O7  1  0.680  0.181  0.500  1.0
  O  O8  1  0.593  0.089  0.000  1.0
  O  O9  1  0.093  0.911  0.500  1.0
  O  O10  1  0.097  0.307  0.711  1.0
  O  O11  1  0.597  0.693  0.789  1.0
  O  O12  1  0.597  0.693  0.211  1.0
  O  O13  1  0.097  0.307  0.289  1.0
  V  V14  1  0.017  0.136  1.000  1.0
  V  V15  1  0.517  0.864  0.500  1.0
[/CIF]
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