Tm2Pd3Pt2
Alexandria ALEXAlex-ID: agm008769397 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_1613_spg1
Tm2PdPt5 Tm3Pt5 Tm2Pd5Pt
2024-03-07 12:20:18.528816
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008769397).
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 agm008769397
data_agm008769397
_cell_length_a 5.09607
_cell_length_b 5.09607
_cell_length_c 6.55210
_cell_angle_alpha 82.91358
_cell_angle_beta 82.91358
_cell_angle_gamma 48.12466
_cell_volume 125.53725
_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 0.08047 0.08047 0.76180 1.00000
Tm2 Tm 0.91953 0.91953 0.23820 1.00000
Pd1 Pd 0.50000 0.50000 0.50000 1.00000
Pd2 Pd 0.35737 0.35737 0.92650 1.00000
Pd3 Pd 0.64263 0.64263 0.07350 1.00000
Pt1 Pt 0.21466 0.21466 0.34881 1.00000
Pt2 Pt 0.78534 0.78534 0.65119 1.00000
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