The structure described by Li2WFeO6 is Corundum-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 in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. In the second Li site, Li(2) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. W(1) 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 WO6 octahedra that share corners with six equivalent Fe(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-40°. Fe(1) 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 FeO6 octahedra that share corners with six equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-40°. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the second O site, O(2) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the third O site, O(3) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the fourth O site, O(4) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the fifth O site, O(5) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the sixth O site, O(6) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. is represented by the CIF card [CIF]
data_Li2FeWO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.089
_cell_length_b   5.423
_cell_length_c   5.116
_cell_angle_alpha   62.086
_cell_angle_beta   60.646
_cell_angle_gamma   90.098
_symmetry_Int_Tables_number   1
_cell_volume   103.735
_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  0.290  0.875  0.419  1.0
  Li  Li1  1  0.790  0.368  0.422  1.0
  Fe  Fe2  1  0.006  0.011  0.990  1.0
  W  W3  1  0.504  0.510  0.993  1.0
  O  O4  1  0.126  0.223  0.149  1.0
  O  O5  1  0.729  0.227  0.899  1.0
  O  O6  1  0.373  0.230  0.493  1.0
  O  O7  1  0.613  0.716  0.521  1.0
  O  O8  1  0.237  0.725  0.144  1.0
  O  O9  1  0.869  0.723  0.898  1.0
[/CIF]
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The structure described by Li2WFeO6 is Corundum-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 in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. In the second Li site, Li(2) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. W(1) 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 WO6 octahedra that share corners with six equivalent Fe(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-40°. Fe(1) 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 FeO6 octahedra that share corners with six equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 37-40°. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the second O site, O(2) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the third O site, O(3) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the fourth O site, O(4) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the fifth O site, O(5) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. In the sixth O site, O(6) is bonded in a distorted see-saw-like geometry to one Li(1), one Li(2), one W(1), and one Fe(1) atom. is represented by the CIF card [CIF]
data_Li2FeWO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.089
_cell_length_b   5.423
_cell_length_c   5.116
_cell_angle_alpha   62.086
_cell_angle_beta   60.646
_cell_angle_gamma   90.098
_symmetry_Int_Tables_number   1
_cell_volume   103.735
_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  0.290  0.875  0.419  1.0
  Li  Li1  1  0.790  0.368  0.422  1.0
  Fe  Fe2  1  0.006  0.011  0.990  1.0
  W  W3  1  0.504  0.510  0.993  1.0
  O  O4  1  0.126  0.223  0.149  1.0
  O  O5  1  0.729  0.227  0.899  1.0
  O  O6  1  0.373  0.230  0.493  1.0
  O  O7  1  0.613  0.716  0.521  1.0
  O  O8  1  0.237  0.725  0.144  1.0
  O  O9  1  0.869  0.723  0.898  1.0
[/CIF]
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