Ce7Y3Co4
Alexandria ALEXAlex-ID: agm010057775 · 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
A3B4C7_8_spg12
CeY2Co Ce CeCo
2024-03-25 01:18:24.885948
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010057775).
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 agm010057775
data_agm010057775
_cell_length_a 9.43263
_cell_length_b 9.43263
_cell_length_c 10.73147
_cell_angle_alpha 61.37043
_cell_angle_beta 61.37043
_cell_angle_gamma 23.16990
_cell_volume 327.68114
_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 0.32467 0.32467 0.51224 1.00000
Ce2 Ce 0.49432 0.49432 0.81010 1.00000
Ce3 Ce 0.83190 0.83190 0.89350 1.00000
Ce4 Ce 0.67533 0.67533 0.48776 1.00000
Ce5 Ce 0.16810 0.16810 0.10650 1.00000
Ce6 Ce 0.00000 0.00000 0.00000 1.00000
Ce7 Ce 0.50568 0.50568 0.18990 1.00000
Y1 Y 0.31232 0.31232 0.19915 1.00000
Y2 Y 0.68768 0.68768 0.80085 1.00000
Y3 Y 0.00000 0.00000 0.50000 1.00000
Co1 Co 0.65884 0.65884 0.26207 1.00000
Co2 Co 0.34116 0.34116 0.73793 1.00000
Co3 Co 0.89695 0.89695 0.33769 1.00000
Co4 Co 0.10305 0.10305 0.66231 1.00000
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