The compound described by CsGeBr3 is (Cubic) Perovskite structured and crystallizes in the trigonal R3m space group. Cs(1) is bonded to twelve equivalent Br(1) atoms to form a mixture of face and corner-sharing CsBr12 cuboctahedra. Ge(1) is bonded in a 3-coordinate geometry to three equivalent Br(1) atoms. Br(1) is bonded in a distorted single-bond geometry to four equivalent Cs(1) and one Ge(1) atom. is represented by the CIF file [CIF]
data_CsGeBr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.668
_cell_length_b   5.668
_cell_length_c   5.668
_cell_angle_alpha   88.897
_cell_angle_beta   88.897
_cell_angle_gamma   88.897
_symmetry_Int_Tables_number   1
_cell_volume   182.015
_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
  Cs  Cs0  1  0.001  0.001  0.001  1.0
  Ge  Ge1  1  0.477  0.477  0.477  1.0
  Br  Br2  1  0.505  0.029  0.505  1.0
  Br  Br3  1  0.029  0.505  0.505  1.0
  Br  Br4  1  0.505  0.505  0.029  1.0
[/CIF]
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The compound described by CsGeBr3 is (Cubic) Perovskite structured and crystallizes in the trigonal R3m space group. Cs(1) is bonded to twelve equivalent Br(1) atoms to form a mixture of face and corner-sharing CsBr12 cuboctahedra. Ge(1) is bonded in a 3-coordinate geometry to three equivalent Br(1) atoms. Br(1) is bonded in a distorted single-bond geometry to four equivalent Cs(1) and one Ge(1) atom. is represented by the CIF file [CIF]
data_CsGeBr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.668
_cell_length_b   5.668
_cell_length_c   5.668
_cell_angle_alpha   88.897
_cell_angle_beta   88.897
_cell_angle_gamma   88.897
_symmetry_Int_Tables_number   1
_cell_volume   182.015
_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
  Cs  Cs0  1  0.001  0.001  0.001  1.0
  Ge  Ge1  1  0.477  0.477  0.477  1.0
  Br  Br2  1  0.505  0.029  0.505  1.0
  Br  Br3  1  0.029  0.505  0.505  1.0
  Br  Br4  1  0.505  0.505  0.029  1.0
[/CIF]
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