Tm(CuPd2)4
Alexandria ALEXAlex-ID: agm097907186 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1156_spg38
CuPd2 CuPd TmCu2Pd5
2025-06-13 23:00:10
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097907186).
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 agm097907186
data_agm097907186
_cell_length_a 4.38658
_cell_length_b 7.25043
_cell_length_c 6.96743
_cell_angle_alpha 113.88079
_cell_angle_beta 89.06069
_cell_angle_gamma 90.88822
_cell_volume 202.58865
_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 0.27677 0.93665 0.09475 1.00000
Cu1 Cu 0.76705 0.97085 0.80783 1.00000
Cu2 Cu 0.27785 0.47902 0.77514 1.00000
Cu3 Cu 0.75944 0.55436 0.54129 1.00000
Cu4 Cu 0.27326 0.04801 0.51761 1.00000
Pd1 Pd 0.26756 0.20072 0.91181 1.00000
Pd2 Pd 0.77676 0.66211 0.95359 1.00000
Pd3 Pd 0.27007 0.60876 0.19592 1.00000
Pd4 Pd 0.25789 0.33209 0.37862 1.00000
Pd5 Pd 0.26281 0.76695 0.64824 1.00000
Pd6 Pd 0.77444 0.25105 0.65175 1.00000
Pd7 Pd 0.76547 0.35320 0.13590 1.00000
Pd8 Pd 0.77063 0.83623 0.38753 1.00000
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