CeIn3Bi5
Alexandria ALEXAlex-ID: agm072542575 · 空间群: P1 (#1)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB3C5_721_spg1
CeInBi2 Bi In
2024-09-24 15:41:11.785519
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072542575).
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 agm072542575
data_agm072542575
_cell_length_a 6.05303
_cell_length_b 6.10343
_cell_length_c 8.70758
_cell_angle_alpha 75.19754
_cell_angle_beta 76.69393
_cell_angle_gamma 70.04473
_cell_volume 288.70516
_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 0.04146 0.94968 0.01499 1.00000
In1 In 0.21699 0.02956 0.58353 1.00000
In2 In 0.79568 0.98053 0.43910 1.00000
In3 In 0.67186 0.48278 0.61881 1.00000
Bi1 Bi 0.26557 0.56240 0.34108 1.00000
Bi2 Bi 0.59197 0.98507 0.82189 1.00000
Bi3 Bi 0.44791 0.05199 0.19122 1.00000
Bi4 Bi 0.09295 0.49735 0.81302 1.00000
Bi5 Bi 0.86221 0.45804 0.18083 1.00000
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