Ac8YNi4
Alexandria ALEXAlex-ID: agm097955853 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1245_spg38
Ac2Ni YNi Ac
2025-06-22 10:57:14
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097955853).
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 agm097955853
data_agm097955853
_cell_length_a 4.16983
_cell_length_b 11.17416
_cell_length_c 11.42528
_cell_angle_alpha 59.25992
_cell_angle_beta 82.23824
_cell_angle_gamma 86.00547
_cell_volume 453.36353
_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 0.23980 0.22826 0.30669 1.00000
Ac2 Ac 0.26408 0.61766 0.98307 1.00000
Ac3 Ac 0.23876 0.61775 0.61182 1.00000
Ac4 Ac 0.26459 0.22865 0.67737 1.00000
Ac5 Ac 0.84664 0.92314 0.30132 1.00000
Ac6 Ac 0.79197 0.54832 0.33173 1.00000
Ac7 Ac 0.79331 0.29776 0.95702 1.00000
Ac8 Ac 0.72315 0.92302 0.66785 1.00000
Y1 Y 0.47722 0.92337 0.02010 1.00000
Ni1 Ni 0.06943 0.92348 0.86464 1.00000
Ni2 Ni 0.75202 0.42239 0.14749 1.00000
Ni3 Ni 0.75142 0.42339 0.64711 1.00000
Ni4 Ni 0.28761 0.92282 0.48380 1.00000
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