PrHo2US8
Alexandria ALEXAlex-ID: agm004913428 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_380_spg10
PrS2 US3 Ho2S3
2023-01-06 10:58:25.289941
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004913428).
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 agm004913428
data_agm004913428
_cell_length_a 6.26211
_cell_length_b 5.94842
_cell_length_c 8.32263
_cell_angle_alpha 89.95781
_cell_angle_beta 89.99980
_cell_angle_gamma 90.60937
_cell_volume 309.99781
_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
Pr1 Pr 0.00000 0.00000 0.50000 1.00000
Ho1 Ho 0.49995 0.49967 0.75746 1.00000
Ho2 Ho 0.50005 0.50033 0.24254 1.00000
U1 U 0.00000 0.00000 0.00000 1.00000
S1 S 0.13314 0.74978 0.22720 1.00000
S2 S 0.65789 0.75450 0.99971 1.00000
S3 S 0.86627 0.24974 0.22687 1.00000
S4 S 0.86686 0.25022 0.77280 1.00000
S5 S 0.34211 0.24550 0.00029 1.00000
S6 S 0.13373 0.75026 0.77313 1.00000
S7 S 0.57144 0.77836 0.50001 1.00000
S8 S 0.42856 0.22164 0.49999 1.00000
Get direct link