The material structure described by Zr2VCo3 is Frank-Kasper $\mu$ Phase-derived structured and crystallizes in the trigonal R-3m space group. Zr(1) is bonded in a 16-coordinate geometry to four equivalent Zr(1), three equivalent V(1), and nine equivalent Co(1) atoms. V(1) is bonded to six equivalent Zr(1) and six equivalent Co(1) atoms to form distorted VZr6Co6 cuboctahedra that share corners with six equivalent V(1)Zr6Co6 cuboctahedra, corners with twelve equivalent Co(1)Zr6V2Co4 cuboctahedra, edges with six equivalent V(1)Zr6Co6 cuboctahedra, and faces with eighteen equivalent Co(1)Zr6V2Co4 cuboctahedra. Co(1) is bonded to six equivalent Zr(1), two equivalent V(1), and four equivalent Co(1) atoms to form distorted CoZr6V2Co4 cuboctahedra that share corners with four equivalent V(1)Zr6Co6 cuboctahedra, corners with fourteen equivalent Co(1)Zr6V2Co4 cuboctahedra, edges with six equivalent Co(1)Zr6V2Co4 cuboctahedra, faces with six equivalent V(1)Zr6Co6 cuboctahedra, and faces with twelve equivalent Co(1)Zr6V2Co4 cuboctahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Zr2VCo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.787
_cell_length_b   4.787
_cell_length_c   4.787
_cell_angle_alpha   64.076
_cell_angle_beta   64.076
_cell_angle_gamma   64.076
_symmetry_Int_Tables_number   1
_cell_volume   84.526
_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
  Zr  Zr0  1  0.627  0.627  0.627  1.0
  Zr  Zr1  1  0.373  0.373  0.373  1.0
  V  V2  1  0.000  0.000  0.000  1.0
  Co  Co3  1  0.000  0.500  0.000  1.0
  Co  Co4  1  0.500  0.000  0.000  1.0
  Co  Co5  1  0.000  0.000  0.500  1.0
[/CIF]
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The material structure described by Zr2VCo3 is Frank-Kasper $\mu$ Phase-derived structured and crystallizes in the trigonal R-3m space group. Zr(1) is bonded in a 16-coordinate geometry to four equivalent Zr(1), three equivalent V(1), and nine equivalent Co(1) atoms. V(1) is bonded to six equivalent Zr(1) and six equivalent Co(1) atoms to form distorted VZr6Co6 cuboctahedra that share corners with six equivalent V(1)Zr6Co6 cuboctahedra, corners with twelve equivalent Co(1)Zr6V2Co4 cuboctahedra, edges with six equivalent V(1)Zr6Co6 cuboctahedra, and faces with eighteen equivalent Co(1)Zr6V2Co4 cuboctahedra. Co(1) is bonded to six equivalent Zr(1), two equivalent V(1), and four equivalent Co(1) atoms to form distorted CoZr6V2Co4 cuboctahedra that share corners with four equivalent V(1)Zr6Co6 cuboctahedra, corners with fourteen equivalent Co(1)Zr6V2Co4 cuboctahedra, edges with six equivalent Co(1)Zr6V2Co4 cuboctahedra, faces with six equivalent V(1)Zr6Co6 cuboctahedra, and faces with twelve equivalent Co(1)Zr6V2Co4 cuboctahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Zr2VCo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.787
_cell_length_b   4.787
_cell_length_c   4.787
_cell_angle_alpha   64.076
_cell_angle_beta   64.076
_cell_angle_gamma   64.076
_symmetry_Int_Tables_number   1
_cell_volume   84.526
_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
  Zr  Zr0  1  0.627  0.627  0.627  1.0
  Zr  Zr1  1  0.373  0.373  0.373  1.0
  V  V2  1  0.000  0.000  0.000  1.0
  Co  Co3  1  0.000  0.500  0.000  1.0
  Co  Co4  1  0.500  0.000  0.000  1.0
  Co  Co5  1  0.000  0.000  0.500  1.0
[/CIF]
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