Y2Cu2Ni
Alexandria ALEXAlex-ID: agm003402964 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_1633_spg12
YCu2 YNi
2022-02-11 08:42:42.125890
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003402964).
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 agm003402964
data_agm003402964
_cell_length_a 3.94336
_cell_length_b 5.35512
_cell_length_c 10.00215
_cell_angle_alpha 89.18638
_cell_angle_beta 78.63109
_cell_angle_gamma 68.39624
_cell_volume 192.13074
_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
Y1 Y 0.67370 0.31124 0.34136 1.00000
Y2 Y 0.92515 0.27018 0.87952 1.00000
Y3 Y 0.32630 0.68876 0.65864 1.00000
Y4 Y 0.07485 0.72982 0.12048 1.00000
Cu1 Cu 0.09253 0.25842 0.55652 1.00000
Cu2 Cu 0.63033 0.85121 0.88814 1.00000
Cu3 Cu 0.90747 0.74158 0.44348 1.00000
Cu4 Cu 0.36967 0.14879 0.11186 1.00000
Ni1 Ni 0.61287 0.10074 0.67352 1.00000
Ni2 Ni 0.38713 0.89926 0.32648 1.00000
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