Tb2Pu2U5
Alexandria ALEXAlex-ID: agm010021772 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_708_spg12
Tb Pu U
2024-06-28 00:23:14.797862
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010021772).
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 agm010021772
data_agm010021772
_cell_length_a 4.66479
_cell_length_b 6.04501
_cell_length_c 8.87035
_cell_angle_alpha 100.72316
_cell_angle_beta 105.24057
_cell_angle_gamma 112.69487
_cell_volume 210.71714
_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
Tb1 Tb 0.78089 0.17345 0.38842 1.00000
Tb2 Tb 0.21911 0.82655 0.61158 1.00000
Pu1 Pu 0.97369 0.72212 0.22549 1.00000
Pu2 Pu 0.02631 0.27788 0.77451 1.00000
U1 U 0.39614 0.53053 0.26178 1.00000
U2 U 0.60386 0.46947 0.73822 1.00000
U3 U 0.35668 0.72408 0.98922 1.00000
U4 U 0.64332 0.27592 0.01078 1.00000
U5 U 0.00000 0.00000 0.00000 1.00000
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