Ce2TlRu
Alexandria ALEXAlex-ID: agm069587793 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_864_spg12
Ce6TlRu2 Ce5(Tl2Ru)2 CeRu
2025-03-02 02:40:51
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm069587793).
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 agm069587793
data_agm069587793
_cell_length_a 7.32045
_cell_length_b 7.32045
_cell_length_c 7.71839
_cell_angle_alpha 86.33600
_cell_angle_beta 93.66400
_cell_angle_gamma 150.08486
_cell_volume 205.82764
_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 0.23053 0.76947 0.19463 1.00000
Ce2 Ce 0.76947 0.23053 0.80537 1.00000
Ce3 Ce 0.04567 0.95433 0.79990 1.00000
Ce4 Ce 0.95433 0.04567 0.20010 1.00000
Tl1 Tl 0.61044 0.38956 0.46286 1.00000
Tl2 Tl 0.38956 0.61044 0.53714 1.00000
Ru1 Ru 0.60775 0.39225 0.06826 1.00000
Ru2 Ru 0.39225 0.60775 0.93174 1.00000
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