Pu2SbPd
Alexandria ALEXAlex-ID: agm005651243 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_5880_spg9
PuPd2 Pu4Sb3 PuPd
2023-07-13 07:07:36.510985
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005651243).
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 agm005651243
data_agm005651243
_cell_length_a 5.92260
_cell_length_b 6.35204
_cell_length_c 6.35204
_cell_angle_alpha 70.77013
_cell_angle_beta 62.21231
_cell_angle_gamma 62.21231
_cell_volume 185.10506
_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
Pu1 Pu 0.21210 0.28790 0.78790 1.00000
Pu2 Pu 0.28790 0.71210 0.21210 1.00000
Pu3 Pu 0.78790 0.71210 0.21210 1.00000
Pu4 Pu 0.71210 0.28790 0.78790 1.00000
Sb1 Sb 0.75000 0.19835 0.30165 1.00000
Sb2 Sb 0.25000 0.80165 0.69835 1.00000
Pd1 Pd 0.25000 0.20407 0.29593 1.00000
Pd2 Pd 0.75000 0.79593 0.70407 1.00000
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