Tb3Sm2DySe6
Alexandria ALEXAlex-ID: agm033671655 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_498_spg12
SmDy4Se5 Tb3Sm2Se5 Tb4DySe5
2024-12-04 11:38:02
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm033671655).
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 agm033671655
data_agm033671655
_cell_length_a 9.20422
_cell_length_b 9.20422
_cell_length_c 8.25139
_cell_angle_alpha 76.94277
_cell_angle_beta 103.05723
_cell_angle_gamma 154.16511
_cell_volume 296.33032
_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
Tb1 Tb 0.50000 0.50000 0.50000 1.00000
Tb2 Tb 0.16893 0.83107 0.33433 1.00000
Tb3 Tb 0.83107 0.16893 0.66567 1.00000
Sm1 Sm 0.83161 0.16839 0.16511 1.00000
Sm2 Sm 0.16839 0.83161 0.83489 1.00000
Dy1 Dy 0.50000 0.50000 0.00000 1.00000
Se1 Se 0.33632 0.66368 0.91306 1.00000
Se2 Se 0.66550 0.33450 0.57829 1.00000
Se3 Se 0.66368 0.33632 0.08694 1.00000
Se4 Se 0.99818 0.00182 0.75033 1.00000
Se5 Se 0.00182 0.99818 0.24967 1.00000
Se6 Se 0.33450 0.66550 0.42171 1.00000
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