SrSm4U5
Alexandria ALEXAlex-ID: agm012933151 · 空间群: C2/m (#12)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB4C5_474_spg12
Sr Sm U
2024-07-13 22:18:33.941999
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012933151).
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 agm012933151
data_agm012933151
_cell_length_a 8.32036
_cell_length_b 8.32036
_cell_length_c 12.92082
_cell_angle_alpha 48.96027
_cell_angle_beta 48.96027
_cell_angle_gamma 25.80075
_cell_volume 287.75000
_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
Sr1 Sr 0.50000 0.50000 0.00000 1.00000
Sm1 Sm 0.24187 0.24187 0.89289 1.00000
Sm2 Sm 0.00616 0.00616 0.27016 1.00000
Sm3 Sm 0.75813 0.75813 0.10711 1.00000
Sm4 Sm 0.99384 0.99384 0.72984 1.00000
U1 U 0.74446 0.74446 0.42717 1.00000
U2 U 0.83645 0.83645 0.62685 1.00000
U3 U 0.16355 0.16355 0.37315 1.00000
U4 U 0.50000 0.50000 0.50000 1.00000
U5 U 0.25554 0.25554 0.57283 1.00000
获取直接链接