Ca(DyAu2)2
Alexandria ALEXAlex-ID: agm013554306 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_5260_spg2
DyAu2 DyAu CaAu
2025-06-07 21:51:23
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm013554306).
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
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# CIF generated by HEAS from Alexandria entry agm013554306
data_agm013554306
_cell_length_a 10.24056
_cell_length_b 10.24056
_cell_length_c 10.24056
_cell_angle_alpha 158.62185
_cell_angle_beta 154.27678
_cell_angle_gamma 33.68533
_cell_volume 169.74785
_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
Ca1 Ca 0.50000 0.50000 0.00000 1.00000
Dy1 Dy 0.81401 0.31401 0.50000 1.00000
Dy2 Dy 0.18599 0.68599 0.50000 1.00000
Au1 Au 0.66073 0.16073 0.50000 1.00000
Au2 Au 0.33927 0.83927 0.50000 1.00000
Au3 Au 0.06942 0.06942 0.00000 1.00000
Au4 Au 0.93058 0.93058 0.00000 1.00000
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