Er6GaOs2
Alexandria ALEXAlex-ID: agm005804326 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_712_spg71
Er5Os2 ErGa
2023-07-07 06:38:12.703360
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005804326).
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 agm005804326
data_agm005804326
_cell_length_a 8.35281
_cell_length_b 8.35281
_cell_length_c 8.35281
_cell_angle_alpha 103.89184
_cell_angle_beta 112.35313
_cell_angle_gamma 112.30868
_cell_volume 445.46861
_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
Er1 Er 0.54277 0.72343 0.81934 1.00000
Er2 Er 0.45723 0.27657 0.18066 1.00000
Er3 Er 0.09591 0.27657 0.81934 1.00000
Er4 Er 0.90409 0.72343 0.18066 1.00000
Er5 Er 0.79967 0.75483 0.55450 1.00000
Er6 Er 0.20033 0.24517 0.44550 1.00000
Er7 Er 0.20033 0.75483 0.95517 1.00000
Er8 Er 0.79967 0.24517 0.04483 1.00000
Er9 Er 0.68822 0.35530 0.66707 1.00000
Er10 Er 0.31178 0.64470 0.33293 1.00000
Er11 Er 0.31178 0.97885 0.66707 1.00000
Er12 Er 0.68822 0.02115 0.33293 1.00000
Ga1 Ga 0.00000 0.50000 0.50000 1.00000
Ga2 Ga 0.00000 0.00000 0.00000 1.00000
Os1 Os 0.50000 0.37675 0.87675 1.00000
Os2 Os 0.50000 0.62325 0.12325 1.00000
Os3 Os 0.67448 0.00000 0.67448 1.00000
Os4 Os 0.32552 1.00000 0.32552 1.00000
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