Al3Zn4SiRh8
Alexandria ALEXAlex-ID: agm050986943 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4D8_28_spg166
Zn3SiRh4 Al2ZnRh3 Zn2SiRh3
2024-11-10 23:34:22.961349
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm050986943).
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 agm050986943
data_agm050986943
_cell_length_a 14.07458
_cell_length_b 14.07458
_cell_length_c 14.07458
_cell_angle_alpha 17.34202
_cell_angle_beta 17.34202
_cell_angle_gamma 17.34202
_cell_volume 216.16772
_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 0.74999 0.74999 0.74999 1.00000
Al2 Al 0.50000 0.50000 0.50000 1.00000
Al3 Al 0.25001 0.25001 0.25001 1.00000
Zn1 Zn 0.87544 0.87544 0.87544 1.00000
Zn2 Zn 0.62404 0.62404 0.62404 1.00000
Zn3 Zn 0.37596 0.37596 0.37596 1.00000
Zn4 Zn 0.12456 0.12456 0.12456 1.00000
Si1 Si 0.00000 0.00000 0.00000 1.00000
Rh1 Rh 0.81238 0.81238 0.81238 1.00000
Rh2 Rh 0.56285 0.56285 0.56285 1.00000
Rh3 Rh 0.31401 0.31401 0.31401 1.00000
Rh4 Rh 0.06017 0.06017 0.06017 1.00000
Rh5 Rh 0.18762 0.18762 0.18762 1.00000
Rh6 Rh 0.93983 0.93983 0.93983 1.00000
Rh7 Rh 0.68599 0.68599 0.68599 1.00000
Rh8 Rh 0.43715 0.43715 0.43715 1.00000
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