Cs3Ac2SmTe6
Alexandria ALEXAlex-ID: agm025685461 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_598_spg1
CsSmTe2 CsAcTe2
2025-03-09 08:51:18
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm025685461).
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 agm025685461
data_agm025685461
_cell_length_a 11.60254
_cell_length_b 11.60254
_cell_length_c 10.56995
_cell_angle_alpha 70.05099
_cell_angle_beta 109.94901
_cell_angle_gamma 156.05133
_cell_volume 541.31826
_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
Cs1 Cs 0.50000 0.50000 0.00000 1.00000
Cs2 Cs 0.83219 0.16781 0.66556 1.00000
Cs3 Cs 0.16781 0.83219 0.33444 1.00000
Ac1 Ac 0.83600 0.16400 0.17095 1.00000
Ac2 Ac 0.16400 0.83600 0.82905 1.00000
Sm1 Sm 0.50000 0.50000 0.50000 1.00000
Te1 Te 0.34999 0.65001 0.39852 1.00000
Te2 Te 0.67730 0.32270 0.05790 1.00000
Te3 Te 0.65001 0.34999 0.60148 1.00000
Te4 Te 0.00724 0.99276 0.70861 1.00000
Te5 Te 0.99276 0.00724 0.29139 1.00000
Te6 Te 0.32270 0.67730 0.94210 1.00000
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