U(BRh)2
Alexandria ALEXAlex-ID: agm002199750 · 空间群: Fddd (#70)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2C2_14_spg70
UB4 BRh U2BRh6
2018-07-09 08:30:41
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002199750).
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 agm002199750
data_agm002199750
_cell_length_a 5.52768
_cell_length_b 5.52770
_cell_length_c 5.95191
_cell_angle_alpha 107.25358
_cell_angle_beta 107.25494
_cell_angle_gamma 111.17428
_cell_volume 144.35086
_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 0.50741 0.75733 0.51459 1.00000
Rh2 Rh 0.75733 0.50741 0.01459 1.00000
Rh3 Rh 0.49259 0.24268 0.48541 1.00000
Rh4 Rh 0.24267 0.49259 0.98541 1.00000
B1 B 0.56352 0.43649 0.25000 1.00000
B2 B 0.81343 0.18656 0.75001 1.00000
B3 B 0.18657 0.81344 0.24999 1.00000
B4 B 0.43648 0.56351 0.75000 1.00000
U1 U 0.87501 0.12498 0.25000 1.00000
U2 U 0.12499 0.87502 0.75000 1.00000
获取直接链接