AlV6Ru
Alexandria ALEXAlex-ID: agm005807766 · Space group: C2 (#5)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC6_685_spg5
V5Ru AlV3 Al2Ru
2023-07-24 16:06:20.155516
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005807766).
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 agm005807766
data_agm005807766
_cell_length_a 4.55390
_cell_length_b 5.49833
_cell_length_c 5.49834
_cell_angle_alpha 124.48042
_cell_angle_beta 84.41898
_cell_angle_gamma 84.41886
_cell_volume 110.98434
_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 0.50000 0.93018 0.06982 1.00000
V1 V 0.49277 0.94374 0.57308 1.00000
V2 V 0.50724 0.42692 0.05626 1.00000
V3 V 0.50000 0.43286 0.56714 1.00000
V4 V 0.00919 0.55850 0.92891 1.00000
V5 V 0.99080 0.07109 0.44150 1.00000
V6 V 0.00000 0.07010 0.92990 1.00000
Ru1 Ru 0.00000 0.56661 0.43339 1.00000
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