Tb4Dy5Y3
Alexandria ALEXAlex-ID: agm005695451 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C5_119_spg2
DyY5 Tb5Dy TbDy5
2023-06-29 13:41:26.777076
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005695451).
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 agm005695451
data_agm005695451
_cell_length_a 7.11388
_cell_length_b 11.24267
_cell_length_c 12.81582
_cell_angle_alpha 151.28877
_cell_angle_beta 56.32942
_cell_angle_gamma 129.29011
_cell_volume 381.09440
_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 0.91680 0.83407 0.66763 1.00000
Tb2 Tb 0.83218 0.66535 0.83337 1.00000
Tb3 Tb 0.16782 0.33465 0.16663 1.00000
Tb4 Tb 0.08320 0.16593 0.33237 1.00000
Dy1 Dy 0.33198 0.66708 0.83451 1.00000
Dy2 Dy 0.50000 0.00000 0.50000 1.00000
Dy3 Dy 0.75022 0.50131 0.00073 1.00000
Dy4 Dy 0.24978 0.49869 0.99927 1.00000
Dy5 Dy 0.66802 0.33292 0.16549 1.00000
Y1 Y 0.58367 0.16735 0.33331 1.00000
Y2 Y 0.00000 0.00000 0.50000 1.00000
Y3 Y 0.41633 0.83265 0.66669 1.00000
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