Al5(V6Ga)2
Alexandria ALEXAlex-ID: agm003370650 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_61_spg12
V3Ga V13Ga3 AlV
2022-02-06 14:17:48.631609
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003370650).
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 agm003370650
data_agm003370650
_cell_length_a 8.50828
_cell_length_b 6.62379
_cell_length_c 6.52199
_cell_angle_alpha 81.31864
_cell_angle_beta 90.00000
_cell_angle_gamma 129.95996
_cell_volume 276.21584
_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 0.25292 0.50584 0.50620 1.00000
Al2 Al 0.32906 0.65812 0.09730 1.00000
Al3 Al 0.00000 0.00000 0.50000 1.00000
Al4 Al 0.67094 0.34188 0.90270 1.00000
Al5 Al 0.74708 0.49416 0.49380 1.00000
V1 V 0.86719 0.73439 0.10351 1.00000
V2 V 0.06907 0.61057 0.78515 1.00000
V3 V 0.54150 0.61057 0.78515 1.00000
V4 V 0.15477 0.79780 0.39545 1.00000
V5 V 0.64303 0.79780 0.39545 1.00000
V6 V 0.45705 0.91410 0.69570 1.00000
V7 V 0.54295 0.08590 0.30430 1.00000
V8 V 0.84523 0.20220 0.60455 1.00000
V9 V 0.35697 0.20220 0.60455 1.00000
V10 V 0.93093 0.38943 0.21485 1.00000
V11 V 0.45850 0.38943 0.21485 1.00000
V12 V 0.13281 0.26561 0.89649 1.00000
Ga1 Ga 0.73616 0.00000 0.00000 1.00000
Ga2 Ga 0.26384 1.00000 1.00000 1.00000
Get direct link