NdPu2(ThRh)2
Alexandria ALEXAlex-ID: agm011702452 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_258_spg2
Nd Pu ThRh
2024-06-24 11:27:23.290873
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011702452).
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 agm011702452
data_agm011702452
_cell_length_a 6.19864
_cell_length_b 6.19864
_cell_length_c 8.94368
_cell_angle_alpha 68.57636
_cell_angle_beta 68.57636
_cell_angle_gamma 36.02112
_cell_volume 186.59114
_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
Nd1 Nd 0.00000 0.00000 0.00000 1.00000
Pu1 Pu 0.11182 0.11182 0.56566 1.00000
Pu2 Pu 0.88818 0.88818 0.43434 1.00000
Th1 Th 0.33601 0.33601 0.80657 1.00000
Th2 Th 0.66399 0.66399 0.19343 1.00000
Rh1 Rh 0.67683 0.67683 0.75953 1.00000
Rh2 Rh 0.32317 0.32317 0.24047 1.00000
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