Dy4Pu5
Alexandria ALEXAlex-ID: agm009746560 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A4B5_553_spg1
Pu Dy
2024-03-25 11:25:36.120918
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009746560).
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 agm009746560
data_agm009746560
_cell_length_a 9.13588
_cell_length_b 9.13588
_cell_length_c 8.54846
_cell_angle_alpha 76.64186
_cell_angle_beta 76.64186
_cell_angle_gamma 21.59453
_cell_volume 255.22359
_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
Dy1 Dy 0.34045 0.34045 0.99056 1.00000
Dy2 Dy 0.65955 0.65955 0.00944 1.00000
Dy3 Dy 0.25839 0.25839 0.66686 1.00000
Dy4 Dy 0.74161 0.74161 0.33314 1.00000
Pu1 Pu 0.41223 0.41223 0.32354 1.00000
Pu2 Pu 0.58777 0.58777 0.67646 1.00000
Pu3 Pu 0.07053 0.07053 0.34699 1.00000
Pu4 Pu 0.92947 0.92947 0.65301 1.00000
Pu5 Pu 0.00000 0.00000 0.00000 1.00000
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