The compound described by CsGdO2 is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. Cs(1) is bonded in a 6-coordinate geometry to six equivalent O(1) atoms. Gd(1) is bonded to six equivalent O(1) atoms to form edge-sharing GdO6 octahedra. O(1) is bonded to three equivalent Cs(1) and three equivalent Gd(1) atoms to form a mixture of distorted face, corner, and edge-sharing OCs3Gd3 octahedra. The corner-sharing octahedral tilt angles range from 0-39°. is represented by the Crystallographic Information File (CIF) [CIF]
data_CsGdO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.591
_cell_length_b   3.591
_cell_length_c   13.699
_cell_angle_alpha   89.998
_cell_angle_beta   90.001
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   152.985
_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
  Cs  Cs0  1  0.333  0.667  0.750  1.0
  Cs  Cs1  1  0.667  0.333  0.250  1.0
  Gd  Gd2  1  1.000  1.000  0.000  1.0
  Gd  Gd3  1  0.000  0.000  0.500  1.0
  O  O4  1  0.333  0.667  0.417  1.0
  O  O5  1  0.333  0.667  0.083  1.0
  O  O6  1  0.667  0.333  0.583  1.0
  O  O7  1  0.667  0.333  0.917  1.0
[/CIF]
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The compound described by CsGdO2 is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. Cs(1) is bonded in a 6-coordinate geometry to six equivalent O(1) atoms. Gd(1) is bonded to six equivalent O(1) atoms to form edge-sharing GdO6 octahedra. O(1) is bonded to three equivalent Cs(1) and three equivalent Gd(1) atoms to form a mixture of distorted face, corner, and edge-sharing OCs3Gd3 octahedra. The corner-sharing octahedral tilt angles range from 0-39°. is represented by the Crystallographic Information File (CIF) [CIF]
data_CsGdO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.591
_cell_length_b   3.591
_cell_length_c   13.699
_cell_angle_alpha   89.998
_cell_angle_beta   90.001
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   152.985
_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
  Cs  Cs0  1  0.333  0.667  0.750  1.0
  Cs  Cs1  1  0.667  0.333  0.250  1.0
  Gd  Gd2  1  1.000  1.000  0.000  1.0
  Gd  Gd3  1  0.000  0.000  0.500  1.0
  O  O4  1  0.333  0.667  0.417  1.0
  O  O5  1  0.333  0.667  0.083  1.0
  O  O6  1  0.667  0.333  0.583  1.0
  O  O7  1  0.667  0.333  0.917  1.0
[/CIF]
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