Pu3(SnPd2)2
Alexandria ALEXAlex-ID: agm003341978 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_606_spg12
PuSnPd Pu2SnPd3
2022-01-30 01:48:47.387359
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003341978).
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 agm003341978
data_agm003341978
_cell_length_a 3.78636
_cell_length_b 4.99169
_cell_length_c 10.25426
_cell_angle_alpha 97.17018
_cell_angle_beta 90.00000
_cell_angle_gamma 112.28827
_cell_volume 177.69001
_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 0.32250 0.64499 0.90127 1.00000
Pu2 Pu 0.00000 0.00000 0.00000 1.00000
Pu3 Pu 0.67750 0.35501 0.09873 1.00000
Sn1 Sn 0.15390 0.30780 0.59650 1.00000
Sn2 Sn 0.84610 0.69220 0.40350 1.00000
Pd1 Pd 0.59666 0.19331 0.78057 1.00000
Pd2 Pd 0.87263 0.74526 0.67459 1.00000
Pd3 Pd 0.12737 0.25474 0.32541 1.00000
Pd4 Pd 0.40334 0.80669 0.21943 1.00000
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