La7Y2Er3
Alexandria ALEXAlex-ID: agm024653392 · 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
A2B3C7_103_spg10
La7Y LaY2 LaEr2
2024-12-24 02:56:22
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024653392).
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 agm024653392
data_agm024653392
_cell_length_a 17.67083
_cell_length_b 17.67083
_cell_length_c 6.28054
_cell_angle_alpha 86.44937
_cell_angle_beta 93.55063
_cell_angle_gamma 167.86952
_cell_volume 411.31354
_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
La1 La 0.25096 0.74904 0.74361 1.00000
La2 La 0.74904 0.25096 0.25639 1.00000
La3 La 0.58580 0.41420 0.18952 1.00000
La4 La 0.00000 0.00000 0.00000 1.00000
La5 La 0.41420 0.58580 0.81048 1.00000
La6 La 0.91576 0.08424 0.31134 1.00000
La7 La 0.08424 0.91576 0.68866 1.00000
Y1 Y 0.66769 0.33231 0.88292 1.00000
Y2 Y 0.33231 0.66769 0.11708 1.00000
Er1 Er 0.50000 0.50000 0.50000 1.00000
Er2 Er 0.16691 0.83309 0.38648 1.00000
Er3 Er 0.83309 0.16691 0.61352 1.00000
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