Ac8Tb2Y3
Alexandria ALEXAlex-ID: agm005604466 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C8_198_spg2
Tb2Y7 Tb5Y Ac
2023-06-16 18:18:53.283363
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005604466).
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 agm005604466
data_agm005604466
_cell_length_a 6.61661
_cell_length_b 8.54696
_cell_length_c 10.19579
_cell_angle_alpha 64.85294
_cell_angle_beta 83.90404
_cell_angle_gamma 82.53886
_cell_volume 516.68617
_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
Ac1 Ac 0.23349 0.53740 0.07972 1.00000
Ac2 Ac 0.76651 0.46260 0.92028 1.00000
Ac3 Ac 0.15751 0.69350 0.38708 1.00000
Ac4 Ac 0.84249 0.30650 0.61292 1.00000
Ac5 Ac 0.08068 0.84819 0.69395 1.00000
Ac6 Ac 0.30937 0.37191 0.77271 1.00000
Ac7 Ac 0.69063 0.62809 0.22729 1.00000
Ac8 Ac 0.91932 0.15181 0.30605 1.00000
Tb1 Tb 0.61271 0.77838 0.53916 1.00000
Tb2 Tb 0.38729 0.22162 0.46084 1.00000
Y1 Y 0.00000 0.00000 0.00000 1.00000
Y2 Y 0.46134 0.07336 0.15439 1.00000
Y3 Y 0.53866 0.92664 0.84561 1.00000
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