Ce2Nd3SmTe6
Alexandria ALEXAlex-ID: agm025175293 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_201_spg12
Ce2NdTe3 NdTe SmTe
2024-12-06 10:04:14
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm025175293).
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 agm025175293
data_agm025175293
_cell_length_a 10.03699
_cell_length_b 10.03699
_cell_length_c 8.99015
_cell_angle_alpha 76.83164
_cell_angle_beta 103.16836
_cell_angle_gamma 154.20178
_cell_volume 383.23853
_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 0.83201 0.16799 0.16503 1.00000
Ce2 Ce 0.16799 0.83201 0.83497 1.00000
Nd1 Nd 0.50000 0.50000 0.50000 1.00000
Nd2 Nd 0.16504 0.83496 0.33349 1.00000
Nd3 Nd 0.83496 0.16504 0.66651 1.00000
Sm1 Sm 0.50000 0.50000 0.00000 1.00000
Te1 Te 0.33484 0.66516 0.91701 1.00000
Te2 Te 0.66715 0.33285 0.58501 1.00000
Te3 Te 0.66516 0.33484 0.08299 1.00000
Te4 Te 0.00153 0.99847 0.75363 1.00000
Te5 Te 0.99847 0.00153 0.24637 1.00000
Te6 Te 0.33285 0.66715 0.41499 1.00000
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