SrH6Os
Alexandria ALEXAlex-ID: agm005809917 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC6_602_spg15
SrH8Os Sr2H6Os Os
2023-07-10 01:21:35.045791
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005809917).
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 agm005809917
data_agm005809917
_cell_length_a 4.57704
_cell_length_b 5.56579
_cell_length_c 6.21487
_cell_angle_alpha 98.86551
_cell_angle_beta 90.00000
_cell_angle_gamma 114.27873
_cell_volume 142.24257
_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 0.28281 0.00000 0.25000 1.00000
Sr2 Sr 0.71719 1.00000 0.75000 1.00000
H1 H 0.90555 0.16728 0.41198 1.00000
H2 H 0.26172 0.16728 0.91198 1.00000
H3 H 0.25181 0.48039 0.72921 1.00000
H4 H 0.22857 0.48039 0.22921 1.00000
H5 H 0.09445 0.83272 0.58802 1.00000
H6 H 0.73828 0.83272 0.08802 1.00000
H7 H 0.59929 0.35101 0.52571 1.00000
H8 H 0.75172 0.35101 0.02571 1.00000
H9 H 0.74819 0.51961 0.27079 1.00000
H10 H 0.77143 0.51961 0.77079 1.00000
H11 H 0.40071 0.64899 0.47429 1.00000
H12 H 0.24828 0.64899 0.97429 1.00000
Os1 Os 0.00000 0.50000 0.50000 1.00000
Os2 Os 0.50000 0.50000 0.00000 1.00000
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