Tm(PuCd3)2
Alexandria ALEXAlex-ID: agm005773095 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_648_spg12
TmCd2 PuCd2
2023-07-06 16:11:24.940070
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005773095).
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 agm005773095
data_agm005773095
_cell_length_a 6.02815
_cell_length_b 6.02823
_cell_length_c 6.02825
_cell_angle_alpha 93.87341
_cell_angle_beta 93.87504
_cell_angle_gamma 93.87517
_cell_volume 217.48727
_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
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
Pu1 Pu 0.65722 0.65731 0.65731 1.00000
Pu2 Pu 0.34278 0.34269 0.34269 1.00000
Cd1 Cd 0.16387 0.49993 0.83595 1.00000
Cd2 Cd 0.83613 0.16405 0.50007 1.00000
Cd3 Cd 0.83613 0.50007 0.16405 1.00000
Cd4 Cd 0.50000 0.16397 0.83603 1.00000
Cd5 Cd 0.16387 0.83595 0.49993 1.00000
Cd6 Cd 0.50000 0.83603 0.16397 1.00000
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