Ce2Y7Ho2
Alexandria ALEXAlex-ID: agm003326257 · 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
A2B2C7_242_spg12
YHo8 Y5Ho Ce
2022-01-26 22:05:44.083232
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003326257).
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 agm003326257
data_agm003326257
_cell_length_a 5.88998
_cell_length_b 8.07090
_cell_length_c 8.07090
_cell_angle_alpha 89.80329
_cell_angle_beta 75.15356
_cell_angle_gamma 75.15356
_cell_volume 357.68539
_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 0.81959 0.43986 0.43986 1.00000
Ce2 Ce 0.18041 0.56014 0.56014 1.00000
Y1 Y 0.17995 0.04901 0.58935 1.00000
Y2 Y 0.82005 0.41065 0.95099 1.00000
Y3 Y 0.82005 0.95099 0.41065 1.00000
Y4 Y 0.17995 0.58935 0.04901 1.00000
Y5 Y 0.00000 0.00000 0.00000 1.00000
Y6 Y 0.60141 0.77741 0.77741 1.00000
Y7 Y 0.39859 0.22259 0.22259 1.00000
Ho1 Ho 0.50000 0.21907 0.78093 1.00000
Ho2 Ho 0.50000 0.78093 0.21907 1.00000
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