Tm3CuTe2
Alexandria ALEXAlex-ID: agm005757271 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_5_spg15
Tm6CuTe5 TmCu
2023-08-17 16:31:16.630739
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005757271).
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 agm005757271
data_agm005757271
_cell_length_a 7.20694
_cell_length_b 7.20695
_cell_length_c 7.50709
_cell_angle_alpha 99.27265
_cell_angle_beta 99.27257
_cell_angle_gamma 119.97004
_cell_volume 319.77707
_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
Tm1 Tm 0.61959 0.95293 0.78242 1.00000
Tm2 Tm 0.04707 0.38040 0.21758 1.00000
Tm3 Tm 0.89858 0.58999 0.77530 1.00000
Tm4 Tm 0.25665 0.23191 0.77530 1.00000
Tm5 Tm 0.41001 0.10142 0.22470 1.00000
Tm6 Tm 0.76809 0.74335 0.22470 1.00000
Cu1 Cu 0.00256 0.99744 1.00000 1.00000
Cu2 Cu 0.66411 0.33589 1.00000 1.00000
Te1 Te 0.83334 0.16666 0.50000 1.00000
Te2 Te 0.33334 0.66666 0.00000 1.00000
Te3 Te 0.17764 0.82236 0.50000 1.00000
Te4 Te 0.48904 0.51097 0.50000 1.00000
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