Sr2UGeS5
Alexandria ALEXAlex-ID: agm005149440 · Space group: Cmc2_1 (#36)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D5_210_spg36
Sr5(US4)3 Sr2GeS4 Ge GeS
2023-01-19 13:53:06.907303
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005149440).
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 agm005149440
data_agm005149440
_cell_length_a 4.12094
_cell_length_b 8.85675
_cell_length_c 13.26522
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 103.45279
_cell_volume 470.87170
_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 0.86944 0.73888 0.80383 1.00000
Sr2 Sr 0.08681 0.17362 0.65657 1.00000
Sr3 Sr 0.13056 0.26112 0.30383 1.00000
Sr4 Sr 0.91319 0.82638 0.15657 1.00000
U1 U 0.77689 0.55378 0.53114 1.00000
U2 U 0.22311 0.44622 0.03114 1.00000
Ge1 Ge 0.55079 0.10157 0.94494 1.00000
Ge2 Ge 0.44921 0.89843 0.44494 1.00000
S1 S 0.37390 0.74780 0.98895 1.00000
S2 S 0.69328 0.38657 0.90047 1.00000
S3 S 0.49693 0.99386 0.76518 1.00000
S4 S 0.26440 0.52880 0.66860 1.00000
S5 S 0.92629 0.85258 0.56429 1.00000
S6 S 0.62610 0.25220 0.48895 1.00000
S7 S 0.30672 0.61343 0.40047 1.00000
S8 S 0.50307 0.00614 0.26518 1.00000
S9 S 0.73560 0.47120 0.16860 1.00000
S10 S 0.07371 0.14742 0.06429 1.00000
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