Ce3(TmTl2)2
Alexandria ALEXAlex-ID: agm005668010 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_273_spg12
Ce2Tl Tm5Tl4 CeTl
2023-06-26 22:54:49.158131
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005668010).
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 agm005668010
data_agm005668010
_cell_length_a 5.35385
_cell_length_b 5.36365
_cell_length_c 10.24010
_cell_angle_alpha 91.61675
_cell_angle_beta 91.73846
_cell_angle_gamma 59.68872
_cell_volume 253.71241
_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
Ce1 Ce 0.36530 0.36660 0.43858 1.00000
Ce2 Ce 0.00000 0.00000 0.00000 1.00000
Ce3 Ce 0.63470 0.63340 0.56142 1.00000
Tm1 Tm 0.32249 0.32120 0.77665 1.00000
Tm2 Tm 0.67751 0.67880 0.22335 1.00000
Tl1 Tl 0.66226 0.66142 0.89176 1.00000
Tl2 Tl 0.02513 0.02620 0.33846 1.00000
Tl3 Tl 0.97487 0.97380 0.66154 1.00000
Tl4 Tl 0.33774 0.33858 0.10824 1.00000
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