Ce2Os
Alexandria ALEXAlex-ID: agm003294992 · 空间群: Immm (#71)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2_70_spg71
Ce4Os3 Ce7Os3
2022-01-17 08:14:11.030806
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003294992).
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}
}
晶体结构 3D 渲染
加载 3D 结构...
# CIF generated by HEAS from Alexandria entry agm003294992
data_agm003294992
_cell_length_a 3.80055
_cell_length_b 6.29522
_cell_length_c 7.09001
_cell_angle_alpha 116.34326
_cell_angle_beta 105.54658
_cell_angle_gamma 90.00000
_cell_volume 145.05699
_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 0.99991 0.73074 0.99982 1.00000
Ce2 Ce 0.00009 0.26926 0.00018 1.00000
Ce3 Ce 0.28370 0.28359 0.56741 1.00000
Ce4 Ce 0.71630 0.71641 0.43259 1.00000
Os1 Os 0.37592 0.87624 0.75184 1.00000
Os2 Os 0.62408 0.12376 0.24816 1.00000
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