AlNi2
Alexandria ALEXAlex-ID: agm005541334 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2_48_spg8
Al5Ni11 Al3Ni5
2023-05-28 09:15:58.882162
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005541334).
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 agm005541334
data_agm005541334
_cell_length_a 3.70747
_cell_length_b 4.26190
_cell_length_c 5.01927
_cell_angle_alpha 101.51743
_cell_angle_beta 90.00000
_cell_angle_gamma 115.78246
_cell_volume 69.63606
_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
Al1 Al 0.15555 0.31110 0.80859 1.00000
Al2 Al 0.84445 0.68890 0.19141 1.00000
Ni1 Ni 0.17226 0.34452 0.32120 1.00000
Ni2 Ni 0.82774 0.65548 0.67880 1.00000
Ni3 Ni 0.50000 0.00000 0.50000 1.00000
Ni4 Ni 0.50000 0.00000 0.00000 1.00000
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