Tb3Y5Rh
Alexandria ALEXAlex-ID: agm072376953 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C5_1183_spg44
Tb2YRh Y3Rh Tb2Y7
2024-09-25 00:13:13.711398
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072376953).
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 agm072376953
data_agm072376953
_cell_length_a 6.17419
_cell_length_b 6.64076
_cell_length_c 7.17386
_cell_angle_alpha 75.76409
_cell_angle_beta 73.82293
_cell_angle_gamma 86.55294
_cell_volume 273.80529
_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
Tb1 Tb 0.49401 0.02787 0.34085 1.00000
Tb2 Tb 0.57572 0.49970 0.45181 1.00000
Tb3 Tb 0.56876 0.47738 0.95996 1.00000
Y1 Y 0.48010 0.01293 0.83831 1.00000
Y2 Y 0.01618 0.25342 0.13938 1.00000
Y3 Y 0.09035 0.70859 0.75855 1.00000
Y4 Y 0.01122 0.23768 0.64580 1.00000
Y5 Y 0.10927 0.72181 0.25926 1.00000
Rh1 Rh 0.79165 0.86741 0.05157 1.00000
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