Sr3La2SmTe6
Alexandria ALEXAlex-ID: agm004615010 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_28_spg12
La4SmTe5 SrTe SmTe
2022-06-29 21:07:58.549714
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004615010).
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 agm004615010
data_agm004615010
_cell_length_a 4.59001
_cell_length_b 9.32599
_cell_length_c 10.40428
_cell_angle_alpha 104.34739
_cell_angle_beta 102.74327
_cell_angle_gamma 90.00000
_cell_volume 420.14680
_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
Sr1 Sr 0.50000 0.50000 0.00000 1.00000
Sr2 Sr 0.83241 0.16663 0.66483 1.00000
Sr3 Sr 0.16759 0.83337 0.33517 1.00000
La1 La 0.83458 0.66954 0.66916 1.00000
La2 La 0.16542 0.33046 0.33084 1.00000
Sm1 Sm 0.50000 0.00000 0.00000 1.00000
Te1 Te 0.33707 0.91716 0.67414 1.00000
Te2 Te 0.66789 0.58001 0.33579 1.00000
Te3 Te 0.66293 0.08284 0.32586 1.00000
Te4 Te 0.00010 0.24060 0.00020 1.00000
Te5 Te 0.99990 0.75940 0.99980 1.00000
Te6 Te 0.33211 0.41999 0.66421 1.00000
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