Pm2HoS6
Alexandria ALEXAlex-ID: agm097364565 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_3793_spg8
Ho10S19 HoS10 PmS2
2025-04-07 06:53:11
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097364565).
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
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# CIF generated by HEAS from Alexandria entry agm097364565
data_agm097364565
_cell_length_a 5.14547
_cell_length_b 5.31225
_cell_length_c 8.54324
_cell_angle_alpha 88.92434
_cell_angle_beta 85.10536
_cell_angle_gamma 99.02684
_cell_volume 229.66490
_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
Pm1 Pm 0.92020 0.97613 0.00594 1.00000
Pm2 Pm 0.39465 0.87925 0.59863 1.00000
Ho1 Ho 0.48379 0.40770 0.22675 1.00000
S1 S 0.50442 0.62410 0.88378 1.00000
S2 S 0.28466 0.35924 0.51594 1.00000
S3 S 0.01879 0.48079 0.11227 1.00000
S4 S 0.83512 0.72131 0.71840 1.00000
S5 S 0.59446 0.91626 0.28544 1.00000
S6 S 0.46391 0.13522 0.90284 1.00000
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