AcDy(InAu2)2
Alexandria ALEXAlex-ID: agm004804422 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_337_spg166
DyAu2 Ac(InAu)2
2022-07-14 08:41:45.239168
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004804422).
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 agm004804422
data_agm004804422
_cell_length_a 4.93008
_cell_length_b 4.93008
_cell_length_c 9.44359
_cell_angle_alpha 74.86893
_cell_angle_beta 74.86893
_cell_angle_gamma 60.00000
_cell_volume 189.53737
_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
Ac1 Ac 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.50000 0.50000 0.50000 1.00000
In1 In 0.75734 0.75734 0.72798 1.00000
In2 In 0.24266 0.24266 0.27202 1.00000
Au1 Au 0.39045 0.39045 0.82866 1.00000
Au2 Au 0.87042 0.87042 0.38875 1.00000
Au3 Au 0.12958 0.12958 0.61125 1.00000
Au4 Au 0.60955 0.60955 0.17134 1.00000
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