Sm(YEr2)2
Alexandria ALEXAlex-ID: agm018300040 · 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
AB2C4_937_spg65
Sm3(Y2Er)2 YEr5
2025-06-02 14:47:27
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm018300040).
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 agm018300040
data_agm018300040
_cell_length_a 3.53733
_cell_length_b 3.53733
_cell_length_c 17.76538
_cell_angle_alpha 84.26303
_cell_angle_beta 95.73697
_cell_angle_gamma 90.04456
_cell_volume 220.06172
_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
Sm1 Sm 0.50000 0.50000 0.50000 1.00000
Y1 Y 0.78662 0.21338 0.07304 1.00000
Y2 Y 0.21338 0.78662 0.92696 1.00000
Er1 Er 0.92808 0.07192 0.35575 1.00000
Er2 Er 0.07192 0.92808 0.64425 1.00000
Er3 Er 0.64191 0.35809 0.78431 1.00000
Er4 Er 0.35809 0.64191 0.21569 1.00000
获取直接链接