Ce8Hg2Os3
Alexandria ALEXAlex-ID: agm005643979 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C8_329_spg10
CeHg Ce5HgOs2
2023-06-15 21:53:18.374002
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005643979).
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 agm005643979
data_agm005643979
_cell_length_a 4.69295
_cell_length_b 8.89920
_cell_length_c 8.03726
_cell_angle_alpha 105.11435
_cell_angle_beta 89.99976
_cell_angle_gamma 89.99995
_cell_volume 324.05220
_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
Ce1 Ce 0.00001 0.55957 0.24183 1.00000
Ce2 Ce 0.99999 0.44043 0.75817 1.00000
Ce3 Ce 1.00000 0.12357 0.22797 1.00000
Ce4 Ce 0.00000 0.87643 0.77203 1.00000
Ce5 Ce 0.50000 0.63363 0.92932 1.00000
Ce6 Ce 0.50000 0.07621 0.68501 1.00000
Ce7 Ce 0.50000 0.92379 0.31499 1.00000
Ce8 Ce 0.50000 0.36637 0.07068 1.00000
Hg1 Hg 0.49999 0.33138 0.46818 1.00000
Hg2 Hg 0.50001 0.66862 0.53182 1.00000
Os1 Os 0.50000 0.00000 0.00000 1.00000
Os2 Os 1.00000 0.20545 0.91382 1.00000
Os3 Os 0.00000 0.79455 0.08618 1.00000
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