Ac4PuRu2
Alexandria ALEXAlex-ID: agm096567951 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_4558_spg8
Ac3Ru Ac2PuRu2 Pu
2025-04-11 12:54:31
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm096567951).
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 agm096567951
data_agm096567951
_cell_length_a 5.40456
_cell_length_b 4.37282
_cell_length_c 10.43110
_cell_angle_alpha 91.10267
_cell_angle_beta 76.55953
_cell_angle_gamma 91.13427
_cell_volume 239.69426
_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
Ac1 Ac 0.09435 0.49363 0.80014 1.00000
Ac2 Ac 0.31473 0.01471 0.37630 1.00000
Ac3 Ac 0.68551 0.98528 0.62408 1.00000
Ac4 Ac 0.90610 0.50648 0.19975 1.00000
Pu1 Pu 0.50010 0.00020 0.00006 1.00000
Ru1 Ru 0.00020 0.00008 0.99989 1.00000
Ru2 Ru 0.99901 0.49963 0.49978 1.00000
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