Pu3(AlPt2)2
Alexandria ALEXAlex-ID: agm005646928 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_33_spg2
PuAlPt Pu2AlPt3
2023-06-26 18:35:17.469784
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005646928).
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 agm005646928
data_agm005646928
_cell_length_a 4.30107
_cell_length_b 5.95827
_cell_length_c 8.59124
_cell_angle_alpha 114.26523
_cell_angle_beta 90.00000
_cell_angle_gamma 111.15747
_cell_volume 184.31531
_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 0.63040 0.26080 0.69428 1.00000
Pu2 Pu 0.00000 0.00000 0.00000 1.00000
Pu3 Pu 0.36960 0.73920 0.30572 1.00000
Al1 Al 0.67313 0.34627 0.34384 1.00000
Al2 Al 0.32687 0.65373 0.65616 1.00000
Pt1 Pt 0.70990 0.41981 0.07554 1.00000
Pt2 Pt 0.29010 0.58019 0.92446 1.00000
Pt3 Pt 0.91589 0.83178 0.59120 1.00000
Pt4 Pt 0.08411 0.16822 0.40880 1.00000
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