Ce(Pm3Tl)2
Alexandria ALEXAlex-ID: agm012232668 · 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
AB2C6_351_spg12
Pm2Tl Ce Pm
2024-06-29 08:10:23.738619
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012232668).
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 agm012232668
data_agm012232668
_cell_length_a 6.75697
_cell_length_b 6.75697
_cell_length_c 12.42346
_cell_angle_alpha 72.91305
_cell_angle_beta 72.91305
_cell_angle_gamma 32.77075
_cell_volume 292.26791
_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
Ce1 Ce 0.00000 0.00000 0.00000 1.00000
Pm1 Pm 0.31605 0.31605 0.87482 1.00000
Pm2 Pm 0.68395 0.68395 0.12518 1.00000
Pm3 Pm 0.69231 0.69231 0.41248 1.00000
Pm4 Pm 0.01471 0.01471 0.65208 1.00000
Pm5 Pm 0.98529 0.98529 0.34792 1.00000
Pm6 Pm 0.30769 0.30769 0.58752 1.00000
Tl1 Tl 0.63871 0.63871 0.79255 1.00000
Tl2 Tl 0.36129 0.36129 0.20745 1.00000
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