Pu2Cu2Rh
Alexandria ALEXAlex-ID: agm003403196 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_1048_spg12
PuCuRh Pu2Cu3Rh Pu
2022-02-10 11:11:47.062433
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003403196).
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 agm003403196
data_agm003403196
_cell_length_a 4.50317
_cell_length_b 5.55487
_cell_length_c 8.83220
_cell_angle_alpha 69.99423
_cell_angle_beta 75.23061
_cell_angle_gamma 66.08786
_cell_volume 188.03675
_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 0.32727 0.30023 0.04523 1.00000
Pu2 Pu 0.60813 0.17174 0.61200 1.00000
Pu3 Pu 0.67273 0.69977 0.95477 1.00000
Pu4 Pu 0.39187 0.82826 0.38800 1.00000
Cu1 Cu 0.00189 0.13837 0.85785 1.00000
Cu2 Cu 0.09610 0.43898 0.36882 1.00000
Cu3 Cu 0.99811 0.86163 0.14215 1.00000
Cu4 Cu 0.90390 0.56102 0.63118 1.00000
Rh1 Rh 0.73126 0.25633 0.28115 1.00000
Rh2 Rh 0.26874 0.74367 0.71885 1.00000
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