V7Mo
Alexandria ALEXAlex-ID: agm005547752 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB7_17_spg166
V5Mo V
2023-05-29 10:40:56.638403
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005547752).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm005547752
data_agm005547752
_cell_length_a 6.03930
_cell_length_b 6.03930
_cell_length_c 6.03930
_cell_angle_alpha 90.54004
_cell_angle_beta 90.54005
_cell_angle_gamma 89.45994
_cell_volume 220.24309
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
V1 V 0.62274 0.62274 0.37726 1.00000
V2 V 0.62406 0.12502 0.37594 1.00000
V3 V 0.12502 0.62406 0.37594 1.00000
V4 V 0.12599 0.12599 0.37465 1.00000
V5 V 0.87401 0.37465 0.12599 1.00000
V6 V 0.37465 0.87401 0.12599 1.00000
V7 V 0.37594 0.37594 0.12502 1.00000
V8 V 0.62406 0.62406 0.87498 1.00000
V9 V 0.62535 0.12599 0.87401 1.00000
V10 V 0.12599 0.62535 0.87401 1.00000
V11 V 0.87401 0.87401 0.62535 1.00000
V12 V 0.87498 0.37594 0.62406 1.00000
V13 V 0.37594 0.87498 0.62406 1.00000
V14 V 0.37726 0.37726 0.62274 1.00000
Mo1 Mo 0.87262 0.87262 0.12738 1.00000
Mo2 Mo 0.12738 0.12738 0.87262 1.00000
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