Al2(V2W)3
Alexandria ALEXAlex-ID: agm005609186 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C6_220_spg65
VW AlV3 AlV
2023-06-14 10:58:01.156815
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005609186).
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 agm005609186
data_agm005609186
_cell_length_a 2.66756
_cell_length_b 8.10401
_cell_length_c 8.12461
_cell_angle_alpha 66.97913
_cell_angle_beta 91.73041
_cell_angle_gamma 91.66680
_cell_volume 161.54793
_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
Al1 Al 0.99922 0.27170 0.72806 1.00000
Al2 Al 0.00078 0.72830 0.27194 1.00000
V1 V 0.63757 0.40087 0.40066 1.00000
V2 V 0.36243 0.59913 0.59934 1.00000
V3 V 0.61685 0.90883 0.42570 1.00000
V4 V 0.38315 0.09117 0.57430 1.00000
V5 V 0.61696 0.42519 0.90914 1.00000
V6 V 0.38304 0.57481 0.09086 1.00000
W1 W 0.97846 0.21349 0.21374 1.00000
W2 W 0.02154 0.78651 0.78626 1.00000
W3 W 0.50000 0.00000 0.00000 1.00000
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