Ce2Nd3PuTe6
Alexandria ALEXAlex-ID: agm036699735 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_1_spg12
Ce2Nd3PuTe6
2024-10-16 02:44:03.001929
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm036699735).
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 agm036699735
data_agm036699735
_cell_length_a 7.73319
_cell_length_b 7.73319
_cell_length_c 7.83233
_cell_angle_alpha 80.54228
_cell_angle_beta 80.54228
_cell_angle_gamma 120.04375
_cell_volume 382.90796
_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
Ce1 Ce 0.66609 0.33391 0.00000 1.00000
Ce2 Ce 0.33391 0.66609 0.00000 1.00000
Nd1 Nd 0.83239 0.16761 0.50000 1.00000
Nd2 Nd 0.16761 0.83239 0.50000 1.00000
Nd3 Nd 0.50000 0.50000 0.50000 1.00000
Pu1 Pu 0.00000 0.00000 0.00000 1.00000
Te1 Te 0.58738 0.91789 0.24715 1.00000
Te2 Te 0.75280 0.75280 0.75166 1.00000
Te3 Te 0.41262 0.08211 0.75285 1.00000
Te4 Te 0.91789 0.58738 0.24715 1.00000
Te5 Te 0.24720 0.24720 0.24834 1.00000
Te6 Te 0.08211 0.41262 0.75285 1.00000
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