AlH8Pt2Rh
Alexandria ALEXAlex-ID: agm007526892 · Space group: I-4m2 (#119)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_296_spg119
H10Pt AlPt2 AlRh H8Rh3
2024-02-07 23:29:58
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007526892).
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 agm007526892
data_agm007526892
_cell_length_a 5.45672
_cell_length_b 5.45672
_cell_length_c 5.45672
_cell_angle_alpha 130.03852
_cell_angle_beta 130.03852
_cell_angle_gamma 73.34519
_cell_volume 92.96789
_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 0.75000 0.25000 0.50000 1.00000
H1 H 0.14369 0.11312 0.48761 1.00000
H2 H 0.62550 0.11312 0.96942 1.00000
H3 H 0.34392 0.85631 0.96942 1.00000
H4 H 0.88688 0.37450 0.03058 1.00000
H5 H 0.62550 0.65608 0.51239 1.00000
H6 H 0.34392 0.37450 0.48761 1.00000
H7 H 0.14369 0.65608 0.03058 1.00000
H8 H 0.88688 0.85631 0.51239 1.00000
Pt1 Pt 0.25000 0.75000 0.50000 1.00000
Pt2 Pt 0.50000 0.50000 0.00000 1.00000
Rh1 Rh 0.00000 0.00000 0.00000 1.00000
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