Pt6Rh5
Alexandria ALEXAlex-ID: agm024536051 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A5B6_504_spg71
Pt3Rh2 PtRh2
2024-11-01 03:37:07.125119
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024536051).
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 agm024536051
data_agm024536051
_cell_length_a 9.17532
_cell_length_b 9.17532
_cell_length_c 6.77647
_cell_angle_alpha 75.80047
_cell_angle_beta 75.80047
_cell_angle_gamma 17.33273
_cell_volume 164.64450
_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
Pt1 Pt 0.68233 0.68233 0.54635 1.00000
Pt2 Pt 0.04526 0.04526 0.64152 1.00000
Pt3 Pt 0.31767 0.31767 0.45365 1.00000
Pt4 Pt 0.95474 0.95474 0.35848 1.00000
Pt5 Pt 0.59293 0.59293 0.26657 1.00000
Pt6 Pt 0.40707 0.40707 0.73343 1.00000
Rh1 Rh 0.13774 0.13774 0.90959 1.00000
Rh2 Rh 0.86226 0.86226 0.09041 1.00000
Rh3 Rh 0.22910 0.22910 0.17540 1.00000
Rh4 Rh 0.50000 0.50000 0.00000 1.00000
Rh5 Rh 0.77090 0.77090 0.82460 1.00000
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