VMo
Traditional Materials TRAMP-ID: mp-995205 · Space group: P-6m2 (#187)
Basic Information
Formula
VMo
MP-ID
mp-995205
Elements
2
Sites
2
Density
8.0552
g/cm³
Volume
30.28
ų
Cell a
2.6988
Å
Cell b
2.6988
Å
Cell c
4.8004
Å
α Angle
90.00
°
β Angle
90.00
°
γ Angle
120.00
°
Space Group
P-6m2
Point Group
-6m2
Crystal System
Hexagonal
Bravais Lattice
hP
Stability
No
Packing Fraction
0.7405
X-ray Diffraction
Diffraction Pattern
X-axis: 2θ (°); Y-axis: relative intensity; Cu Kα ; λ=1.5418 Å
Diffraction Peaks (Top 20)
| 2θ | d (Å) | I | hkl |
|---|---|---|---|
| 18.48 | 4.8004 | 29.1 | (0,0,0,1) |
| 37.47 | 2.4002 | 48.6 | (0,0,0,2) |
| 38.52 | 2.3372 | 44.2 | (1,0,-1,0) |
| 43.04 | 2.1014 | 50.0 | (1,-1,0,1) |
| 43.04 | 2.1014 | 100.0 | (1,0,-1,1) |
| 54.82 | 1.6745 | 10.2 | (1,-1,0,2) |
| 54.82 | 1.6745 | 20.3 | (1,0,-1,2) |
| 57.60 | 1.6001 | 1.5 | (0,0,0,3) |
| 69.68 | 1.3494 | 14.3 | (2,-1,-1,0) |
| 69.68 | 1.3494 | 7.2 | (1,1,-2,0) |
| 71.45 | 1.3203 | 31.2 | (1,0,-1,3) |
| 72.80 | 1.2990 | 3.2 | (2,-1,-1,1) |
| 72.80 | 1.2990 | 1.6 | (1,1,-2,1) |
| 79.94 | 1.2001 | 4.9 | (0,0,0,4) |
| 81.90 | 1.1763 | 18.4 | (2,-1,-1,2) |
| 81.90 | 1.1763 | 9.2 | (1,1,-2,2) |
| 82.55 | 1.1686 | 1.6 | (2,-2,0,0) |
| 82.55 | 1.1686 | 3.2 | (2,0,-2,0) |
| 85.52 | 1.1355 | 6.5 | (2,-2,0,1) |
| 85.52 | 1.1355 | 13.0 | (2,0,-2,1) |
Energy Properties
Formation Energy/atom
0.34410
eV/atom
Energy/atom
-19.73668
eV/atom
Energy above Hull
0.4457
eV/atom
Uncorrected Energy
-9.6209
eV/atom
Volume/atom
15.14
ų
c/a Ratio
1.7787
Electronic Properties
Metallic
Metal
Band Gap
0
eV
Direct Gap
No
CBM
N/A
eV
Magnetic Properties
Magnetic
No
Total Mag. Moment
0.0022
μB
Mag. Ordering
NM
Mag. Sites
0
Magnetization/Volume
0.000070
μB/ų
Elastic Properties
Elastic data not available
Feature Analysis
Composition Overview
Element Composition (atomic fraction)
Composition Info
Major / Matrix Element
V · 0.500
Element Family
N/A
Solute Fraction
0.500
Interstitial Fraction
0.000
Traditional Material Features
ROM Blended-Feature Radar
Rating & Classification
Tier
A
Score
0.634
Family
Binary Alloy
Matrix Element
V · 0.500
Related Tasks
Citation & References
Materials Project Page
https://materialsproject.org/materials/mp-995205
Reference Citation
The crystal structure and related material properties of VMo were obtained from the Materials Project database (MP-ID: mp-995205, database version v2026.04.13).
Literature Citation
Horton, M.K., Huck, P., Yang, R.X. et al. Accelerated data-driven materials science with the Materials Project. Nat. Mater. 24, 1522–1532 (2025). https://doi.org/10.1038/s41563-025-02272-0
3D Crystal Structure Rendering
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Raw CIF Data
# generated using pymatgen
data_VMo
_symmetry_space_group_name_H-M 'P 1'
_cell_length_a 2.69878443
_cell_length_b 2.69878443
_cell_length_c 4.80038200
_cell_angle_alpha 90.00000000
_cell_angle_beta 90.00000000
_cell_angle_gamma 120.00001054
_symmetry_Int_Tables_number 1
_chemical_formula_structural VMo
_chemical_formula_sum 'V1 Mo1'
_cell_volume 30.27908702
_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
V V0 1 0.00000000 0.00000000 0.00000000 1.0
Mo Mo1 1 0.33333300 0.66666700 0.50000000 1.0
