The material structure described by TiP2 is Cotunnite structured and crystallizes in the orthorhombic Pnma space group. Ti(1) is bonded in a 9-coordinate geometry to four equivalent P(2) and five equivalent P(1) atoms. There are two inequivalent P sites. In the first P site, P(2) is bonded in a 8-coordinate geometry to four equivalent Ti(1), two equivalent P(1), and two equivalent P(2) atoms. In the second P site, P(1) is bonded in a 7-coordinate geometry to five equivalent Ti(1) and two equivalent P(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_TiP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.349
_cell_length_b   6.170
_cell_length_c   8.265
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   170.772
_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
  Ti  Ti0  1  0.250  0.768  0.334  1.0
  Ti  Ti1  1  0.750  0.232  0.666  1.0
  Ti  Ti2  1  0.250  0.268  0.166  1.0
  Ti  Ti3  1  0.750  0.732  0.834  1.0
  P  P4  1  0.250  0.412  0.863  1.0
  P  P5  1  0.750  0.588  0.137  1.0
  P  P6  1  0.250  0.912  0.637  1.0
  P  P7  1  0.750  0.088  0.363  1.0
  P  P8  1  0.750  0.120  0.960  1.0
  P  P9  1  0.250  0.880  0.040  1.0
  P  P10  1  0.750  0.620  0.540  1.0
  P  P11  1  0.250  0.380  0.460  1.0
[/CIF]
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The material structure described by TiP2 is Cotunnite structured and crystallizes in the orthorhombic Pnma space group. Ti(1) is bonded in a 9-coordinate geometry to four equivalent P(2) and five equivalent P(1) atoms. There are two inequivalent P sites. In the first P site, P(2) is bonded in a 8-coordinate geometry to four equivalent Ti(1), two equivalent P(1), and two equivalent P(2) atoms. In the second P site, P(1) is bonded in a 7-coordinate geometry to five equivalent Ti(1) and two equivalent P(2) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_TiP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.349
_cell_length_b   6.170
_cell_length_c   8.265
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   170.772
_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
  Ti  Ti0  1  0.250  0.768  0.334  1.0
  Ti  Ti1  1  0.750  0.232  0.666  1.0
  Ti  Ti2  1  0.250  0.268  0.166  1.0
  Ti  Ti3  1  0.750  0.732  0.834  1.0
  P  P4  1  0.250  0.412  0.863  1.0
  P  P5  1  0.750  0.588  0.137  1.0
  P  P6  1  0.250  0.912  0.637  1.0
  P  P7  1  0.750  0.088  0.363  1.0
  P  P8  1  0.750  0.120  0.960  1.0
  P  P9  1  0.250  0.880  0.040  1.0
  P  P10  1  0.750  0.620  0.540  1.0
  P  P11  1  0.250  0.380  0.460  1.0
[/CIF]
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