Y8Ni2Au
Alexandria ALEXAlex-ID: agm006015181 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_295_spg12
Y3Ni Y2Au
2023-09-27 21:07:44
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006015181).
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 agm006015181
data_agm006015181
_cell_length_a 5.70570
_cell_length_b 7.71302
_cell_length_c 7.71302
_cell_angle_alpha 114.16779
_cell_angle_beta 98.68780
_cell_angle_gamma 98.68780
_cell_volume 297.48008
_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 0.57834 0.34169 0.08141 1.00000
Y2 Y 0.57834 0.08141 0.34169 1.00000
Y3 Y 0.17668 0.37779 0.37779 1.00000
Y4 Y 0.99144 0.23358 0.77217 1.00000
Y5 Y 0.99144 0.77217 0.23358 1.00000
Y6 Y 0.80610 0.62917 0.62917 1.00000
Y7 Y 0.39672 0.92506 0.66528 1.00000
Y8 Y 0.39672 0.66528 0.92506 1.00000
Ni1 Ni 0.49160 0.70008 0.30633 1.00000
Ni2 Ni 0.49160 0.30633 0.70008 1.00000
Au1 Au 0.10068 0.00138 0.00138 1.00000
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