The structure described by GdCoO3 is (Cubic) Perovskite structured and crystallizes in the tetragonal P4/mmm space group. Gd(1) is bonded to four equivalent O(1) and eight equivalent O(2) atoms to form GdO12 cuboctahedra that share corners with twelve equivalent Gd(1)O12 cuboctahedra, faces with six equivalent Gd(1)O12 cuboctahedra, and faces with eight equivalent Co(1)O6 octahedra. Co(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form CoO6 octahedra that share corners with six equivalent Co(1)O6 octahedra and faces with eight equivalent Gd(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. There are two inequivalent O sites. In the first O site, O(1) is bonded to four equivalent Gd(1) and two equivalent Co(1) atoms to form a mixture of distorted corner and edge-sharing OGd4Co2 octahedra. The corner-sharing octahedra are not tilted. In the second O site, O(2) is bonded in a distorted linear geometry to four equivalent Gd(1) and two equivalent Co(1) atoms. is represented by the CIF card [CIF]
data_GdCoO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.773
_cell_length_b   3.858
_cell_length_c   3.774
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   54.935
_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
  Gd  Gd0  1  0.000  0.000  0.000  1.0
  Co  Co1  1  0.500  0.500  0.500  1.0
  O  O2  1  0.500  0.000  0.500  1.0
  O  O3  1  0.000  0.500  0.500  1.0
  O  O4  1  0.500  0.500  0.000  1.0
[/CIF]
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The structure described by GdCoO3 is (Cubic) Perovskite structured and crystallizes in the tetragonal P4/mmm space group. Gd(1) is bonded to four equivalent O(1) and eight equivalent O(2) atoms to form GdO12 cuboctahedra that share corners with twelve equivalent Gd(1)O12 cuboctahedra, faces with six equivalent Gd(1)O12 cuboctahedra, and faces with eight equivalent Co(1)O6 octahedra. Co(1) is bonded to two equivalent O(1) and four equivalent O(2) atoms to form CoO6 octahedra that share corners with six equivalent Co(1)O6 octahedra and faces with eight equivalent Gd(1)O12 cuboctahedra. The corner-sharing octahedra are not tilted. There are two inequivalent O sites. In the first O site, O(1) is bonded to four equivalent Gd(1) and two equivalent Co(1) atoms to form a mixture of distorted corner and edge-sharing OGd4Co2 octahedra. The corner-sharing octahedra are not tilted. In the second O site, O(2) is bonded in a distorted linear geometry to four equivalent Gd(1) and two equivalent Co(1) atoms. is represented by the CIF card [CIF]
data_GdCoO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.773
_cell_length_b   3.858
_cell_length_c   3.774
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   54.935
_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
  Gd  Gd0  1  0.000  0.000  0.000  1.0
  Co  Co1  1  0.500  0.500  0.500  1.0
  O  O2  1  0.500  0.000  0.500  1.0
  O  O3  1  0.000  0.500  0.500  1.0
  O  O4  1  0.500  0.500  0.000  1.0
[/CIF]
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