La4OsCl4
Alexandria ALEXAlex-ID: agm012979986 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C4_31_spg12
La6OsCl11 La La3OsCl3
2025-01-02 07:53:14
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012979986).
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 agm012979986
data_agm012979986
_cell_length_a 7.11706
_cell_length_b 7.11706
_cell_length_c 11.20809
_cell_angle_alpha 57.98182
_cell_angle_beta 122.01818
_cell_angle_gamma 144.91571
_cell_volume 271.21616
_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
La1 La 0.69535 0.30465 0.77570 1.00000
La2 La 0.30465 0.69535 0.22430 1.00000
La3 La 0.10048 0.89952 0.42707 1.00000
La4 La 0.89952 0.10048 0.57293 1.00000
Os1 Os 0.50000 0.50000 0.50000 1.00000
Cl1 Cl 0.33218 0.66782 0.74547 1.00000
Cl2 Cl 0.11329 0.88671 0.88811 1.00000
Cl3 Cl 0.66782 0.33218 0.25453 1.00000
Cl4 Cl 0.88671 0.11329 0.11189 1.00000
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