V13Au3
Alexandria ALEXAlex-ID: agm007782003 · Space group: Amm2 (#38)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B13_7_spg38
V3Au2 V7Au
2024-05-15 21:47:15.244574
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007782003).
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 agm007782003
data_agm007782003
_cell_length_a 6.06554
_cell_length_b 6.06554
_cell_length_c 6.18719
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 89.76147
_cell_volume 227.62966
_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 0.00920 0.50273 0.24149 1.00000
V2 V 0.49385 0.50615 0.24273 1.00000
V3 V 0.49727 0.99080 0.24149 1.00000
V4 V 0.25098 0.26281 0.50000 1.00000
V5 V 0.73719 0.74902 0.50000 1.00000
V6 V 0.26724 0.73276 0.50000 1.00000
V7 V 0.00920 0.50273 0.75851 1.00000
V8 V 0.49385 0.50615 0.75727 1.00000
V9 V 0.49727 0.99080 0.75851 1.00000
V10 V 0.73824 0.26176 0.00000 1.00000
V11 V 0.26549 0.26984 0.00000 1.00000
V12 V 0.73016 0.73451 0.00000 1.00000
V13 V 0.25825 0.74175 0.00000 1.00000
Au1 Au 0.00772 0.99228 0.24242 1.00000
Au2 Au 0.73635 0.26365 0.50000 1.00000
Au3 Au 0.00772 0.99228 0.75758 1.00000
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