Y(Zn5Rh)2
Alexandria ALEXAlex-ID: agm003385919 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C10_62_spg69
YZn4Rh Y2Zn17 Zn3Rh
2022-02-12 12:15:15.074244
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003385919).
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 agm003385919
data_agm003385919
_cell_length_a 5.46586
_cell_length_b 6.75233
_cell_length_c 6.74269
_cell_angle_alpha 80.55808
_cell_angle_beta 66.08897
_cell_angle_gamma 66.12526
_cell_volume 208.03019
_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
Y1 Y 0.00000 0.00000 0.00000 1.00000
Zn1 Zn 0.34789 0.64304 0.66119 1.00000
Zn2 Zn 0.65211 0.35696 0.33881 1.00000
Zn3 Zn 0.99092 0.35696 0.66119 1.00000
Zn4 Zn 0.00908 0.64304 0.33881 1.00000
Zn5 Zn 0.00000 0.00000 0.50000 1.00000
Zn6 Zn 0.50000 0.00000 0.50000 1.00000
Zn7 Zn 0.28217 0.21867 0.21700 1.00000
Zn8 Zn 0.71783 0.78133 0.78300 1.00000
Zn9 Zn 0.50084 0.78133 0.21700 1.00000
Zn10 Zn 0.49916 0.21867 0.78300 1.00000
Rh1 Rh 0.00000 0.50000 0.00000 1.00000
Rh2 Rh 0.50000 0.50000 0.00000 1.00000
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