Pm(Tm2Sn)2
Alexandria ALEXAlex-ID: agm003440906 · 空间群: R-3m (#166)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2C4_152_spg166
Tm5Sn3 Pm3Tm2Sn3 Tm
2022-02-19 21:24:24.020546
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003440906).
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 agm003440906
data_agm003440906
_cell_length_a 4.99168
_cell_length_b 4.99168
_cell_length_c 10.81374
_cell_angle_alpha 76.65568
_cell_angle_beta 76.65568
_cell_angle_gamma 60.00000
_cell_volume 224.90601
_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
Pm1 Pm 0.50000 0.50000 0.50000 1.00000
Tm1 Tm 0.70147 0.70147 0.89558 1.00000
Tm2 Tm 0.89255 0.89255 0.32235 1.00000
Tm3 Tm 0.29853 0.29853 0.10442 1.00000
Tm4 Tm 0.10745 0.10745 0.67765 1.00000
Sn1 Sn 0.60156 0.60156 0.19531 1.00000
Sn2 Sn 0.39844 0.39844 0.80469 1.00000
获取直接链接