The material described by Te is High Pressure (4-7GPa) Tellurium structured and crystallizes in the orthorhombic Pmc2_1 space group. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to two equivalent Te(1) and four equivalent Te(2) atoms to form a mixture of distorted edge and corner-sharing TeTe6 octahedra. The corner-sharing octahedral tilt angles range from 0-2°. In the second Te site, Te(2) is bonded to two equivalent Te(2) and four equivalent Te(1) atoms to form a mixture of distorted edge and corner-sharing TeTe6 octahedra. The corner-sharing octahedral tilt angles range from 0-5°. is represented by the Crystallographic Information File (CIF) [CIF]
data_Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.131
_cell_length_b   4.743
_cell_length_c   8.986
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   133.427
_cell_formula_units_Z   4
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
  Te  Te0  1  0.500  0.545  0.761  1.0
  Te  Te1  1  0.500  0.455  0.261  1.0
  Te  Te2  1  0.500  0.987  0.009  1.0
  Te  Te3  1  0.500  0.013  0.509  1.0
[/CIF]
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The material described by Te is High Pressure (4-7GPa) Tellurium structured and crystallizes in the orthorhombic Pmc2_1 space group. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded to two equivalent Te(1) and four equivalent Te(2) atoms to form a mixture of distorted edge and corner-sharing TeTe6 octahedra. The corner-sharing octahedral tilt angles range from 0-2°. In the second Te site, Te(2) is bonded to two equivalent Te(2) and four equivalent Te(1) atoms to form a mixture of distorted edge and corner-sharing TeTe6 octahedra. The corner-sharing octahedral tilt angles range from 0-5°. is represented by the Crystallographic Information File (CIF) [CIF]
data_Te
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.131
_cell_length_b   4.743
_cell_length_c   8.986
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   133.427
_cell_formula_units_Z   4
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
  Te  Te0  1  0.500  0.545  0.761  1.0
  Te  Te1  1  0.500  0.455  0.261  1.0
  Te  Te2  1  0.500  0.987  0.009  1.0
  Te  Te3  1  0.500  0.013  0.509  1.0
[/CIF]
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