Tb5(SmTm)2
Alexandria ALEXAlex-ID: agm009763013 · 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
A2B2C5_313_spg12
Tb4SmTm4 Tb2Sm
2024-05-15 15:37:19.584642
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009763013).
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 agm009763013
data_agm009763013
_cell_length_a 6.15646
_cell_length_b 6.15646
_cell_length_c 14.66585
_cell_angle_alpha 69.50365
_cell_angle_beta 69.50365
_cell_angle_gamma 33.61411
_cell_volume 286.40105
_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
Tb1 Tb 0.11084 0.11084 0.55676 1.00000
Tb2 Tb 0.88916 0.88916 0.44324 1.00000
Tb3 Tb 0.77801 0.77801 0.88956 1.00000
Tb4 Tb 0.22199 0.22199 0.11044 1.00000
Tb5 Tb 0.00000 0.00000 0.00000 1.00000
Sm1 Sm 0.33224 0.33224 0.66773 1.00000
Sm2 Sm 0.66776 0.66776 0.33227 1.00000
Tm1 Tm 0.44545 0.44545 0.22089 1.00000
Tm2 Tm 0.55455 0.55455 0.77911 1.00000
获取直接链接