TmPd3Pt
Alexandria ALEXAlex-ID: agm005757201 · Space group: P2/c (#13)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_7315_spg13
Tm2PdPt5 Tm2Pd5Pt TmPd8
2023-07-05 09:17:01.114933
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005757201).
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 agm005757201
data_agm005757201
_cell_length_a 5.12028
_cell_length_b 5.36425
_cell_length_c 7.87753
_cell_angle_alpha 90.00006
_cell_angle_beta 89.99980
_cell_angle_gamma 55.70057
_cell_volume 178.74233
_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 0.50000 0.00000 0.70501 1.00000
Tm2 Tm 1.00000 0.50000 0.29499 1.00000
Pd1 Pd 0.33233 0.85190 0.37398 1.00000
Pd2 Pd 0.16767 0.64810 0.62602 1.00000
Pd3 Pd 0.83233 0.35189 0.62602 1.00000
Pd4 Pd 0.66767 0.14811 0.37398 1.00000
Pd5 Pd 0.00000 1.00000 0.92351 1.00000
Pd6 Pd 0.50000 0.50000 0.07649 1.00000
Pt1 Pt 0.50000 1.00000 0.08090 1.00000
Pt2 Pt 0.00000 0.50000 0.91910 1.00000
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