DyCuNi2
Alexandria ALEXAlex-ID: agm005679478 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_281_spg166
Dy3Cu2Ni7 DyCu2 Dy2Cu4Ni3
2023-07-12 07:51:27.694629
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005679478).
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 agm005679478
data_agm005679478
_cell_length_a 5.03268
_cell_length_b 5.03268
_cell_length_c 8.60624
_cell_angle_alpha 72.99920
_cell_angle_beta 72.99919
_cell_angle_gamma 60.00001
_cell_volume 177.69006
_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 0.86238 0.86238 0.41286 1.00000
Dy2 Dy 0.13762 0.13762 0.58714 1.00000
Dy3 Dy 0.00000 0.00000 0.00000 1.00000
Cu1 Cu 0.66638 0.66638 0.00086 1.00000
Cu2 Cu 0.33362 0.33362 0.99914 1.00000
Cu3 Cu 0.50000 0.50000 0.50000 1.00000
Ni1 Ni 0.41533 0.41533 0.24896 1.00000
Ni2 Ni 0.92039 0.41533 0.24896 1.00000
Ni3 Ni 0.41533 0.92039 0.24896 1.00000
Ni4 Ni 0.58467 0.58467 0.75104 1.00000
Ni5 Ni 0.58467 0.07961 0.75104 1.00000
Ni6 Ni 0.07961 0.58467 0.75104 1.00000
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