Pu4In(Si2Pd)2
Alexandria ALEXAlex-ID: agm020075422 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4D4_13_spg12
PuSiPd Pu2Si3Pd PuIn3 Pu2Si2Pd
2024-09-13 13:04:00.684530
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020075422).
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 agm020075422
data_agm020075422
_cell_length_a 8.04351
_cell_length_b 8.04351
_cell_length_c 6.98984
_cell_angle_alpha 74.10082
_cell_angle_beta 74.10082
_cell_angle_gamma 30.84485
_cell_volume 222.30536
_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 0.65580 0.65580 0.56986 1.00000
Pu2 Pu 0.34420 0.34420 0.43014 1.00000
Pu3 Pu 0.57721 0.57721 0.13027 1.00000
Pu4 Pu 0.42279 0.42279 0.86973 1.00000
In1 In 0.00000 0.00000 0.50000 1.00000
Si1 Si 0.93634 0.93634 0.15184 1.00000
Si2 Si 0.06366 0.06366 0.84816 1.00000
Si3 Si 0.80405 0.80405 0.75303 1.00000
Si4 Si 0.19595 0.19595 0.24697 1.00000
Pd1 Pd 0.77984 0.77984 0.12345 1.00000
Pd2 Pd 0.22016 0.22016 0.87655 1.00000
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