Li2Pu3Sb4
Alexandria ALEXAlex-ID: agm005687620 · 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
A2B3C4_899_spg2
Li3PuSb2 PuSb2 Pu4Sb3
2023-06-27 10:17:33.343874
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005687620).
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
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# CIF generated by HEAS from Alexandria entry agm005687620
data_agm005687620
_cell_length_a 4.65478
_cell_length_b 6.86945
_cell_length_c 8.16402
_cell_angle_alpha 109.96411
_cell_angle_beta 106.56955
_cell_angle_gamma 90.00301
_cell_volume 233.79501
_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
Li1 Li 0.66990 0.00011 0.33984 1.00000
Li2 Li 0.33010 0.99989 0.66016 1.00000
Pu1 Pu 0.13478 0.59953 0.26957 1.00000
Pu2 Pu 0.86522 0.40047 0.73043 1.00000
Pu3 Pu 0.00000 0.00000 0.00000 1.00000
Sb1 Sb 0.49456 0.70540 0.98914 1.00000
Sb2 Sb 0.21434 0.22772 0.42872 1.00000
Sb3 Sb 0.50544 0.29460 0.01086 1.00000
Sb4 Sb 0.78566 0.77228 0.57128 1.00000
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