TmNbSb
Alexandria ALEXAlex-ID: agm002294595 · 空间群: Pnma (#62)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC_6_spg62
Nb TmSb
2018-11-13 09:32:18
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002294595).
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 agm002294595
data_agm002294595
_cell_length_a 3.96361
_cell_length_b 7.61396
_cell_length_c 9.08866
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 274.28481
_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
Sb1 Sb 0.75000 0.25192 0.14284 1.00000
Sb2 Sb 0.25000 0.24810 0.64284 1.00000
Sb3 Sb 0.75000 0.75192 0.35716 1.00000
Sb4 Sb 0.25000 0.74810 0.85716 1.00000
Nb1 Nb 0.25000 0.61807 0.55271 1.00000
Nb2 Nb 0.75000 0.38195 0.44729 1.00000
Nb3 Nb 0.25000 0.11807 0.94729 1.00000
Nb4 Nb 0.75000 0.88195 0.05271 1.00000
Tm1 Tm 0.25000 0.05498 0.33743 1.00000
Tm2 Tm 0.75000 0.44504 0.83743 1.00000
Tm3 Tm 0.25000 0.55498 0.16257 1.00000
Tm4 Tm 0.75000 0.94504 0.66257 1.00000
获取直接链接