Y8Cu2Rh
Alexandria ALEXAlex-ID: agm006015013 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_1400_spg5
Y3Rh YCu Y
2023-10-12 11:06:33.583337
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006015013).
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 agm006015013
data_agm006015013
_cell_length_a 5.93343
_cell_length_b 7.73832
_cell_length_c 7.73832
_cell_angle_alpha 114.96333
_cell_angle_beta 100.86081
_cell_angle_gamma 100.86082
_cell_volume 301.67513
_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 0.59017 0.34246 0.08938 1.00000
Y2 Y 0.59017 0.08938 0.34246 1.00000
Y3 Y 0.17636 0.36568 0.36568 1.00000
Y4 Y 0.98725 0.20764 0.79656 1.00000
Y5 Y 0.98725 0.79656 0.20764 1.00000
Y6 Y 0.80357 0.64093 0.64093 1.00000
Y7 Y 0.36842 0.91364 0.66121 1.00000
Y8 Y 0.36842 0.66121 0.91364 1.00000
Rh1 Rh 0.14023 0.00380 0.00380 1.00000
Cu1 Cu 0.49391 0.70157 0.31105 1.00000
Cu2 Cu 0.49391 0.31105 0.70157 1.00000
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