Yb8Sb5Te
Alexandria ALEXAlex-ID: agm078255331 · 空间群: I-4 (#82)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB5C8_5_spg82
Yb8Sb5Te
2025-01-13 00:33:33
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm078255331).
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 agm078255331
data_agm078255331
_cell_length_a 8.12720
_cell_length_b 8.12720
_cell_length_c 8.12720
_cell_angle_alpha 109.48771
_cell_angle_beta 109.48771
_cell_angle_gamma 109.43825
_cell_volume 413.23794
_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
Yb1 Yb 0.48227 0.23597 0.60365 1.00000
Yb2 Yb 0.76403 0.36768 0.24630 1.00000
Yb3 Yb 0.63232 0.87862 0.39635 1.00000
Yb4 Yb 0.12138 0.51773 0.75370 1.00000
Yb5 Yb 0.62735 0.87411 0.90042 1.00000
Yb6 Yb 0.12589 0.02632 0.75325 1.00000
Yb7 Yb 0.97368 0.72693 0.09958 1.00000
Yb8 Yb 0.27307 0.37265 0.24675 1.00000
Sb1 Sb 0.87185 0.24918 0.87734 1.00000
Sb2 Sb 0.75082 0.62815 0.62267 1.00000
Sb3 Sb 0.37185 0.99452 0.12266 1.00000
Sb4 Sb 0.00548 0.12815 0.37733 1.00000
Sb5 Sb 0.50000 0.50000 0.00000 1.00000
Te1 Te 0.25000 0.75000 0.50000 1.00000
获取直接链接