Eu2S9I
Alexandria ALEXAlex-ID: agm101684352 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C9_732_spg1
Eu3S4 S8I EuI2
2025-05-21 12:38:52
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm101684352).
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 agm101684352
data_agm101684352
_cell_length_a 4.22567
_cell_length_b 9.46732
_cell_length_c 11.58306
_cell_angle_alpha 50.32297
_cell_angle_beta 89.48174
_cell_angle_gamma 92.68944
_cell_volume 355.79847
_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
Eu1 Eu 0.23987 0.35623 0.35098 1.00000
Eu2 Eu 0.91582 0.59603 0.81693 1.00000
S1 S 0.24873 0.23980 0.98876 1.00000
S2 S 0.75885 0.41290 0.14083 1.00000
S3 S 0.75778 0.51073 0.40513 1.00000
S4 S 0.58440 0.66321 0.06080 1.00000
S5 S 0.43456 0.78404 0.84822 1.00000
S6 S 0.79262 0.85352 0.49638 1.00000
S7 S 0.39607 0.43284 0.76874 1.00000
S8 S 0.17225 0.94814 0.53650 1.00000
S9 S 0.71922 0.22991 0.56264 1.00000
I1 I 0.97983 0.97265 0.02409 1.00000
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