AcTb8Tm3
Alexandria ALEXAlex-ID: agm005998326 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C8_277_spg71
Tb5Tm4 Tb5Tm Ac
2023-09-12 21:31:30
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005998326).
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 agm005998326
data_agm005998326
_cell_length_a 8.73705
_cell_length_b 8.73704
_cell_length_c 8.73705
_cell_angle_alpha 97.99918
_cell_angle_beta 137.12557
_cell_angle_gamma 97.35371
_cell_volume 422.38679
_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 0.99999 0.00000 0.99999 1.00000
Tb1 Tb 0.50889 0.26999 0.23904 1.00000
Tb2 Tb 0.49111 0.73014 0.76111 1.00000
Tb3 Tb 0.96905 0.73001 0.23890 1.00000
Tb4 Tb 0.03096 0.26986 0.76097 1.00000
Tb5 Tb 0.17182 0.42531 0.25331 1.00000
Tb6 Tb 0.82818 0.08149 0.25349 1.00000
Tb7 Tb 0.82800 0.57469 0.74651 1.00000
Tb8 Tb 0.17199 0.91851 0.74669 1.00000
Tm1 Tm 0.50000 0.72605 0.22605 1.00000
Tm2 Tm 0.50000 0.27395 0.77395 1.00000
Tm3 Tm 0.99999 0.50000 0.50000 1.00000
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