Re5Sb
Alexandria ALEXAlex-ID: agm005458720 · 空间群: Cm (#8)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB5_2_spg8
Sb Re
2023-03-22 22:07:33.780875
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005458720).
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 agm005458720
data_agm005458720
_cell_length_a 5.37416
_cell_length_b 5.37416
_cell_length_c 6.64522
_cell_angle_alpha 74.30536
_cell_angle_beta 74.30536
_cell_angle_gamma 31.41390
_cell_volume 96.00365
_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
Re1 Re 0.01784 0.01784 0.01541 1.00000
Re2 Re 0.32858 0.32858 0.33449 1.00000
Re3 Re 0.64960 0.64960 0.65917 1.00000
Re4 Re 0.60357 0.60357 0.29176 1.00000
Re5 Re 0.94056 0.94056 0.59765 1.00000
Sb1 Sb 0.29318 0.29318 0.93485 1.00000
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