KEuSiS4
Alexandria ALEXAlex-ID: agm005263969 · Space group: P2_1 (#4)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD4_801_spg11
Eu3S4 SiS8 K2Si2S5 KS5
2023-05-06 20:53:36.114372
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005263969).
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 agm005263969
data_agm005263969
_cell_length_a 6.64452
_cell_length_b 6.64927
_cell_length_c 8.80313
_cell_angle_alpha 72.63622
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 371.20860
_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
K1 K 0.69068 0.22643 0.06598 1.00000
K2 K 0.19068 0.77357 0.93402 1.00000
Eu1 Eu 0.21781 0.73019 0.44657 1.00000
Eu2 Eu 0.71781 0.26981 0.55343 1.00000
Si1 Si 0.67579 0.72088 0.68108 1.00000
Si2 Si 0.17579 0.27912 0.31892 1.00000
S1 S 0.13103 0.08970 0.55932 1.00000
S2 S 0.67491 0.91278 0.83356 1.00000
S3 S 0.94441 0.51326 0.27042 1.00000
S4 S 0.44094 0.46933 0.28937 1.00000
S5 S 0.63103 0.91030 0.44068 1.00000
S6 S 0.94094 0.53067 0.71063 1.00000
S7 S 0.17491 0.08722 0.16644 1.00000
S8 S 0.44441 0.48674 0.72958 1.00000
Get direct link