Pr3(PuCo2)2
Alexandria ALEXAlex-ID: agm005669222 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_361_spg12
PuCo2 Pr
2023-06-26 22:09:25.343511
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005669222).
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 agm005669222
data_agm005669222
_cell_length_a 4.02614
_cell_length_b 5.97476
_cell_length_c 8.82288
_cell_angle_alpha 101.86764
_cell_angle_beta 89.99989
_cell_angle_gamma 109.69043
_cell_volume 195.00158
_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
Pr1 Pr 0.37809 0.75616 0.61447 1.00000
Pr2 Pr 0.00000 0.00000 0.00000 1.00000
Pr3 Pr 0.62191 0.24384 0.38553 1.00000
Pu1 Pu 0.32049 0.64098 0.21455 1.00000
Pu2 Pu 0.67951 0.35902 0.78545 1.00000
Co1 Co 0.71793 0.43586 0.08588 1.00000
Co2 Co 0.08490 0.16981 0.63764 1.00000
Co3 Co 0.91510 0.83019 0.36236 1.00000
Co4 Co 0.28207 0.56414 0.91412 1.00000
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