Tm2Zn2SbRh5
Alexandria ALEXAlex-ID: agm005141925 · 空间群: P4/mbm (#127)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2C2D5_50_spg127
Zn5SbRh6 Tm4Sb6Rh7 Tm2SbRh5 TmZnRh2
2022-07-15 06:38:39.183463
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005141925).
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 agm005141925
data_agm005141925
_cell_length_a 3.63407
_cell_length_b 9.65228
_cell_length_c 9.65228
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 338.57327
_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
Tm1 Tm 0.00000 0.67277 0.17277 1.00000
Tm2 Tm 0.00000 0.32723 0.82723 1.00000
Tm3 Tm 0.00000 0.17277 0.32723 1.00000
Tm4 Tm 0.00000 0.82723 0.67277 1.00000
Zn1 Zn 0.00000 0.12463 0.62463 1.00000
Zn2 Zn 0.00000 0.87537 0.37537 1.00000
Zn3 Zn 0.00000 0.62463 0.87537 1.00000
Zn4 Zn 0.00000 0.37537 0.12463 1.00000
Sb1 Sb 0.00000 0.00000 0.00000 1.00000
Sb2 Sb 0.00000 0.50000 0.50000 1.00000
Rh1 Rh 0.50000 0.20452 0.06806 1.00000
Rh2 Rh 0.50000 0.79548 0.93194 1.00000
Rh3 Rh 0.50000 0.06806 0.79548 1.00000
Rh4 Rh 0.50000 0.70452 0.43194 1.00000
Rh5 Rh 0.50000 0.93194 0.20452 1.00000
Rh6 Rh 0.50000 0.29548 0.56806 1.00000
Rh7 Rh 0.50000 0.56806 0.70452 1.00000
Rh8 Rh 0.50000 0.43194 0.29548 1.00000
Rh9 Rh 0.50000 0.50000 0.00000 1.00000
Rh10 Rh 0.50000 0.00000 0.50000 1.00000
获取直接链接