Tm3(Cu2Pd)2
Alexandria ALEXAlex-ID: agm005606545 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_272_spg12
Tm2Cu7 Tm3Pd4 TmPd
2023-06-27 00:04:50.666658
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005606545).
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 agm005606545
data_agm005606545
_cell_length_a 4.32518
_cell_length_b 5.51570
_cell_length_c 8.08645
_cell_angle_alpha 71.43377
_cell_angle_beta 74.48837
_cell_angle_gamma 66.91607
_cell_volume 165.96698
_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 0.32672 0.68929 0.65727 1.00000
Tm2 Tm 0.00000 0.00000 0.00000 1.00000
Tm3 Tm 0.67328 0.31071 0.34273 1.00000
Cu1 Cu 0.27534 0.40183 0.04750 1.00000
Cu2 Cu 0.72466 0.59817 0.95250 1.00000
Cu3 Cu 0.03935 0.30299 0.61831 1.00000
Cu4 Cu 0.96065 0.69701 0.38169 1.00000
Pd1 Pd 0.39717 0.93890 0.26677 1.00000
Pd2 Pd 0.60283 0.06110 0.73323 1.00000
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