Y4Co5
Alexandria ALEXAlex-ID: agm005503262 · 空间群: I4/mmm (#139)
基础信息
组成
能量与稳定性
电子结构
其他信息
A4B5_4_spg139
Y3Co4 YCo
2023-03-20 08:04:25.113827
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005503262).
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 agm005503262
data_agm005503262
_cell_length_a 6.65533
_cell_length_b 6.65533
_cell_length_c 6.65533
_cell_angle_alpha 95.90722
_cell_angle_beta 95.90722
_cell_angle_gamma 142.57639
_cell_volume 169.67467
_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
Y1 Y 0.28497 0.00000 0.28497 1.00000
Y2 Y 0.71503 0.00000 0.71503 1.00000
Y3 Y 0.00000 0.71503 0.71503 1.00000
Y4 Y 0.00000 0.28497 0.28497 1.00000
Co1 Co 0.00000 0.00000 0.00000 1.00000
Co2 Co 0.35922 0.64078 0.00000 1.00000
Co3 Co 0.64078 0.64078 0.28156 1.00000
Co4 Co 0.35922 0.35922 0.71844 1.00000
Co5 Co 0.64078 0.35922 0.00000 1.00000
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