The crystal structure described by NaMoO2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Na(1) is bonded to six equivalent O(1) atoms to form NaO6 octahedra that share corners with six equivalent Mo(1)O6 octahedra, edges with six equivalent Na(1)O6 octahedra, and edges with six equivalent Mo(1)O6 octahedra. The corner-sharing octahedral tilt angles are 10°. Mo(1) is bonded to six equivalent O(1) atoms to form MoO6 octahedra that share corners with six equivalent Na(1)O6 octahedra, edges with six equivalent Na(1)O6 octahedra, and edges with six equivalent Mo(1)O6 octahedra. The corner-sharing octahedral tilt angles are 10°. O(1) is bonded to three equivalent Na(1) and three equivalent Mo(1) atoms to form a mixture of corner and edge-sharing ONa3Mo3 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF card [CIF]
data_NaMoO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.543
_cell_length_b   5.543
_cell_length_c   5.543
_cell_angle_alpha   33.916
_cell_angle_beta   33.916
_cell_angle_gamma   33.916
_symmetry_Int_Tables_number   1
_cell_volume   47.261
_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
  Na  Na0  1  0.500  0.500  0.500  1.0
  Mo  Mo1  1  0.000  0.000  0.000  1.0
  O  O2  1  0.265  0.265  0.265  1.0
  O  O3  1  0.735  0.735  0.735  1.0
[/CIF]
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The crystal structure described by NaMoO2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Na(1) is bonded to six equivalent O(1) atoms to form NaO6 octahedra that share corners with six equivalent Mo(1)O6 octahedra, edges with six equivalent Na(1)O6 octahedra, and edges with six equivalent Mo(1)O6 octahedra. The corner-sharing octahedral tilt angles are 10°. Mo(1) is bonded to six equivalent O(1) atoms to form MoO6 octahedra that share corners with six equivalent Na(1)O6 octahedra, edges with six equivalent Na(1)O6 octahedra, and edges with six equivalent Mo(1)O6 octahedra. The corner-sharing octahedral tilt angles are 10°. O(1) is bonded to three equivalent Na(1) and three equivalent Mo(1) atoms to form a mixture of corner and edge-sharing ONa3Mo3 octahedra. The corner-sharing octahedra are not tilted. is represented by the CIF card [CIF]
data_NaMoO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.543
_cell_length_b   5.543
_cell_length_c   5.543
_cell_angle_alpha   33.916
_cell_angle_beta   33.916
_cell_angle_gamma   33.916
_symmetry_Int_Tables_number   1
_cell_volume   47.261
_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
  Na  Na0  1  0.500  0.500  0.500  1.0
  Mo  Mo1  1  0.000  0.000  0.000  1.0
  O  O2  1  0.265  0.265  0.265  1.0
  O  O3  1  0.735  0.735  0.735  1.0
[/CIF]
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