Al(NiPt3)2
Alexandria ALEXAlex-ID: agm014351817 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_330_spg2
NiPt4 NiPt AlPt3
2025-03-02 06:18:01
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm014351817).
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
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# CIF generated by HEAS from Alexandria entry agm014351817
data_agm014351817
_cell_length_a 8.11626
_cell_length_b 6.20972
_cell_length_c 5.92212
_cell_angle_alpha 83.94483
_cell_angle_beta 49.53724
_cell_angle_gamma 46.51793
_cell_volume 129.56103
_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 0.50000 0.50000 0.50000 1.00000
Ni1 Ni 0.17114 0.17114 0.82886 1.00000
Ni2 Ni 0.82886 0.82886 0.17114 1.00000
Pt1 Pt 0.50846 0.82278 0.17722 1.00000
Pt2 Pt 0.17722 0.49154 0.50846 1.00000
Pt3 Pt 0.82278 0.50846 0.49154 1.00000
Pt4 Pt 0.15419 0.84581 0.15419 1.00000
Pt5 Pt 0.84581 0.15419 0.84581 1.00000
Pt6 Pt 0.49154 0.17722 0.82278 1.00000
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