Sr2CeSnSe4Br3
Alexandria ALEXAlex-ID: agm011191925 · Space group: Cmc2_1 (#36)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D3E4_10_spg36
Ce2Se5 SnSe SrBr2 SrSnSe2
2024-05-15 14:27:34.713455
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011191925).
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 agm011191925
data_agm011191925
_cell_length_a 10.58986
_cell_length_b 10.58986
_cell_length_c 7.00887
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.42070
_cell_volume 677.80031
_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 0.62954 0.80608 0.42444 1.00000
Sr2 Sr 0.19392 0.37046 0.42444 1.00000
Sr3 Sr 0.37046 0.19392 0.92444 1.00000
Sr4 Sr 0.80608 0.62954 0.92444 1.00000
Ce1 Ce 0.19288 0.80712 0.42380 1.00000
Ce2 Ce 0.80712 0.19288 0.92380 1.00000
Sn1 Sn 0.66499 0.33501 0.50157 1.00000
Sn2 Sn 0.33501 0.66499 0.00157 1.00000
Se1 Se 0.66894 0.33106 0.13281 1.00000
Se2 Se 0.33106 0.66894 0.63281 1.00000
Se3 Se 0.08138 0.54315 0.16070 1.00000
Se4 Se 0.45685 0.91862 0.16070 1.00000
Se5 Se 0.46365 0.53635 0.13995 1.00000
Se6 Se 0.91862 0.45685 0.66070 1.00000
Se7 Se 0.54315 0.08138 0.66070 1.00000
Se8 Se 0.53635 0.46365 0.63995 1.00000
Br1 Br 0.24781 0.11034 0.33547 1.00000
Br2 Br 0.88966 0.75219 0.33547 1.00000
Br3 Br 0.87511 0.12489 0.31113 1.00000
Br4 Br 0.75219 0.88966 0.83547 1.00000
Br5 Br 0.11034 0.24781 0.83547 1.00000
Br6 Br 0.12489 0.87511 0.81113 1.00000
