Ce5ZnHOs2
Alexandria ALEXAlex-ID: agm006940296 · Space group: Cmc2_1 (#36)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D5_337_spg36
Ce4Os3 Ce2Zn3Os CeH2 Ce7Os3
2024-03-10 22:06:22.327563
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006940296).
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 agm006940296
data_agm006940296
_cell_length_a 8.41360
_cell_length_b 8.41360
_cell_length_c 10.23713
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 147.59651
_cell_volume 388.33627
_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 0.18817 0.81183 0.98714 1.00000
Ce2 Ce 0.86014 0.13986 0.12124 1.00000
Ce3 Ce 0.03044 0.96956 0.30787 1.00000
Ce4 Ce 0.25432 0.74568 0.32168 1.00000
Ce5 Ce 0.46345 0.53655 0.55450 1.00000
Ce6 Ce 0.81183 0.18817 0.48714 1.00000
Ce7 Ce 0.13986 0.86014 0.62124 1.00000
Ce8 Ce 0.96956 0.03044 0.80787 1.00000
Ce9 Ce 0.74568 0.25432 0.82168 1.00000
Ce10 Ce 0.53655 0.46345 0.05450 1.00000
Zn1 Zn 0.63267 0.36733 0.39876 1.00000
Zn2 Zn 0.36733 0.63267 0.89876 1.00000
H1 H 0.02444 0.97556 0.05127 1.00000
H2 H 0.97556 0.02444 0.55127 1.00000
Os1 Os 0.69966 0.30034 0.15536 1.00000
Os2 Os 0.42534 0.57466 0.27821 1.00000
Os3 Os 0.30034 0.69966 0.65536 1.00000
Os4 Os 0.57466 0.42534 0.77821 1.00000
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