Pu5Cu2Pt5
Alexandria ALEXAlex-ID: agm005660099 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_26_spg12
Cu PuPt
2023-06-19 07:18:11.434789
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005660099).
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 agm005660099
data_agm005660099
_cell_length_a 4.13763
_cell_length_b 7.73682
_cell_length_c 8.53080
_cell_angle_alpha 82.16339
_cell_angle_beta 75.96515
_cell_angle_gamma 74.49046
_cell_volume 254.54165
_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 0.50000 0.50000 0.50000 1.00000
Pu2 Pu 0.40021 0.28585 0.91373 1.00000
Pu3 Pu 0.30915 0.06144 0.32025 1.00000
Pu4 Pu 0.69085 0.93856 0.67975 1.00000
Pu5 Pu 0.59979 0.71415 0.08627 1.00000
Cu1 Cu 0.85758 0.52815 0.75670 1.00000
Cu2 Cu 0.14242 0.47185 0.24330 1.00000
Pt1 Pt 0.92788 0.77709 0.36715 1.00000
Pt2 Pt 0.23636 0.69704 0.83023 1.00000
Pt3 Pt 0.76364 0.30296 0.16977 1.00000
Pt4 Pt 0.07212 0.22291 0.63285 1.00000
Pt5 Pt 0.00000 0.00000 0.00000 1.00000
Get direct link