TeOsRh2
Alexandria ALEXAlex-ID: agm002880337 · 空间群: I-42d (#122)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC2_7_spg122
OsRh8 Te8Rh9 Os
2016-12-19 18:33:53
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002880337).
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 agm002880337
data_agm002880337
_cell_length_a 5.74538
_cell_length_b 5.74538
_cell_length_c 7.01799
_cell_angle_alpha 65.83710
_cell_angle_beta 65.83710
_cell_angle_gamma 90.00000
_cell_volume 188.89768
_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
Rh1 Rh 0.65578 0.12500 0.25000 1.00000
Rh2 Rh 0.09422 0.62500 0.25000 1.00000
Rh3 Rh 0.37500 0.34422 0.75000 1.00000
Rh4 Rh 0.87500 0.90578 0.75000 1.00000
Te1 Te 0.50000 0.50000 0.00000 1.00000
Te2 Te 0.25000 0.75000 0.50000 1.00000
Os1 Os 0.00000 0.00000 0.00000 1.00000
Os2 Os 0.75000 0.25000 0.50000 1.00000
获取直接链接