La6CrOs8
Alexandria ALEXAlex-ID: agm072124148 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_202_spg2
CrOs3 CrOs7 La7Os3
2024-10-05 23:04:30.179995
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072124148).
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 agm072124148
data_agm072124148
_cell_length_a 9.54991
_cell_length_b 9.54991
_cell_length_c 9.54991
_cell_angle_alpha 153.75473
_cell_angle_beta 118.34753
_cell_angle_gamma 68.17779
_cell_volume 335.66888
_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 0.47236 0.16675 0.30562 1.00000
La2 La 0.80435 0.50000 0.30435 1.00000
La3 La 0.13887 0.83325 0.30562 1.00000
La4 La 0.52764 0.83325 0.69438 1.00000
La5 La 0.19565 0.50000 0.69565 1.00000
La6 La 0.86113 0.16675 0.69438 1.00000
Cr1 Cr 0.50000 0.00000 0.50000 1.00000
Os1 Os 0.58518 0.58518 0.00000 1.00000
Os2 Os 0.41482 0.41482 0.00000 1.00000
Os3 Os 0.83291 0.33291 0.50000 1.00000
Os4 Os 0.92201 0.92201 0.00000 1.00000
Os5 Os 0.74411 0.74411 0.00000 1.00000
Os6 Os 0.16709 0.66709 0.50000 1.00000
Os7 Os 0.07799 0.07799 0.00000 1.00000
Os8 Os 0.25589 0.25589 0.00000 1.00000
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