La5(PmTh)2
Alexandria ALEXAlex-ID: agm009496002 · 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_199_spg12
La7Pm LaPm LaTh4
2024-06-24 11:50:37.007238
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009496002).
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 agm009496002
data_agm009496002
_cell_length_a 8.18464
_cell_length_b 8.18464
_cell_length_c 8.26072
_cell_angle_alpha 72.83944
_cell_angle_beta 72.83944
_cell_angle_gamma 36.80055
_cell_volume 315.05430
_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
La1 La 0.55372 0.55372 0.68371 1.00000
La2 La 0.44628 0.44628 0.31629 1.00000
La3 La 0.88404 0.88404 0.68411 1.00000
La4 La 0.11596 0.11596 0.31589 1.00000
La5 La 0.00000 0.00000 0.00000 1.00000
Pm1 Pm 0.77926 0.77926 0.31724 1.00000
Pm2 Pm 0.22074 0.22074 0.68276 1.00000
Th1 Th 0.66984 0.66984 0.00088 1.00000
Th2 Th 0.33016 0.33016 0.99912 1.00000
获取直接链接