The crystal structure described by ReVO4 is beta Vanadium nitride-derived structured and crystallizes in the monoclinic C2/m space group. V(1) is bonded to one O(1), one O(2), and four equivalent O(3) atoms to form VO6 octahedra that share corners with eight equivalent Re(1)O6 octahedra and edges with two equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-51°. Re(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form ReO6 octahedra that share corners with eight equivalent V(1)O6 octahedra and edges with two equivalent Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-51°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one V(1) and two equivalent Re(1) atoms. In the second O site, O(2) is bonded in a trigonal planar geometry to one V(1) and two equivalent Re(1) atoms. In the third O site, O(3) is bonded in a distorted T-shaped geometry to two equivalent V(1) and one Re(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_VReO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.729
_cell_length_b   5.473
_cell_length_c   5.473
_cell_angle_alpha   61.807
_cell_angle_beta   91.264
_cell_angle_gamma   91.264
_symmetry_Int_Tables_number   1
_cell_volume   124.813
_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
  V  V0  1  0.493  0.513  0.013  1.0
  V  V1  1  0.507  0.987  0.487  1.0
  Re  Re2  1  0.000  0.030  0.970  1.0
  Re  Re3  1  0.000  0.470  0.530  1.0
  O  O4  1  0.219  0.132  0.632  1.0
  O  O5  1  0.191  0.655  0.155  1.0
  O  O6  1  0.809  0.845  0.345  1.0
  O  O7  1  0.781  0.368  0.868  1.0
  O  O8  1  0.299  0.155  0.137  1.0
  O  O9  1  0.299  0.637  0.655  1.0
  O  O10  1  0.701  0.345  0.363  1.0
  O  O11  1  0.701  0.863  0.845  1.0
[/CIF]
.
The crystal structure described by ReVO4 is beta Vanadium nitride-derived structured and crystallizes in the monoclinic C2/m space group. V(1) is bonded to one O(1), one O(2), and four equivalent O(3) atoms to form VO6 octahedra that share corners with eight equivalent Re(1)O6 octahedra and edges with two equivalent V(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-51°. Re(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form ReO6 octahedra that share corners with eight equivalent V(1)O6 octahedra and edges with two equivalent Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 39-51°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one V(1) and two equivalent Re(1) atoms. In the second O site, O(2) is bonded in a trigonal planar geometry to one V(1) and two equivalent Re(1) atoms. In the third O site, O(3) is bonded in a distorted T-shaped geometry to two equivalent V(1) and one Re(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_VReO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.729
_cell_length_b   5.473
_cell_length_c   5.473
_cell_angle_alpha   61.807
_cell_angle_beta   91.264
_cell_angle_gamma   91.264
_symmetry_Int_Tables_number   1
_cell_volume   124.813
_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
  V  V0  1  0.493  0.513  0.013  1.0
  V  V1  1  0.507  0.987  0.487  1.0
  Re  Re2  1  0.000  0.030  0.970  1.0
  Re  Re3  1  0.000  0.470  0.530  1.0
  O  O4  1  0.219  0.132  0.632  1.0
  O  O5  1  0.191  0.655  0.155  1.0
  O  O6  1  0.809  0.845  0.345  1.0
  O  O7  1  0.781  0.368  0.868  1.0
  O  O8  1  0.299  0.155  0.137  1.0
  O  O9  1  0.299  0.637  0.655  1.0
  O  O10  1  0.701  0.345  0.363  1.0
  O  O11  1  0.701  0.863  0.845  1.0
[/CIF]
.