Dy2Al3Au4
Alexandria ALEXAlex-ID: agm005661940 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_99_spg14
Dy(AlAu)2 DyAu2
2023-06-26 17:09:03.408795
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005661940).
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 agm005661940
data_agm005661940
_cell_length_a 7.30837
_cell_length_b 6.71178
_cell_length_c 7.56606
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 107.92626
_cell_volume 353.11457
_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
Dy1 Dy 0.55746 0.18982 0.30597 1.00000
Dy2 Dy 0.94254 0.81018 0.80597 1.00000
Dy3 Dy 0.44254 0.81018 0.69403 1.00000
Dy4 Dy 0.05746 0.18982 0.19403 1.00000
Al1 Al 0.00000 0.50000 0.50000 1.00000
Al2 Al 0.50000 0.50000 0.00000 1.00000
Al3 Al 0.74079 0.23673 0.90439 1.00000
Al4 Al 0.75921 0.76327 0.40439 1.00000
Al5 Al 0.25921 0.76327 0.09561 1.00000
Al6 Al 0.24079 0.23673 0.59561 1.00000
Au1 Au 0.82933 0.11608 0.58356 1.00000
Au2 Au 0.67067 0.88392 0.08356 1.00000
Au3 Au 0.17067 0.88392 0.41644 1.00000
Au4 Au 0.32933 0.11608 0.91644 1.00000
Au5 Au 0.87938 0.55076 0.15328 1.00000
Au6 Au 0.62062 0.44924 0.65328 1.00000
Au7 Au 0.12062 0.44924 0.84672 1.00000
Au8 Au 0.37938 0.55076 0.34672 1.00000
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