YMg
Alexandria ALEXAlex-ID: agm005446243 · 空间群: Cm (#8)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB_37_spg8
YMg
2023-03-21 13:10:25.927864
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005446243).
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 agm005446243
data_agm005446243
_cell_length_a 6.84765
_cell_length_b 6.84765
_cell_length_c 7.25240
_cell_angle_alpha 74.94887
_cell_angle_beta 74.94887
_cell_angle_gamma 30.81187
_cell_volume 167.75141
_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 0.71077 0.71077 0.59685 1.00000
Y2 Y 0.00698 0.00698 0.46059 1.00000
Y3 Y 0.69238 0.69238 0.11576 1.00000
Mg1 Mg 0.02441 0.02441 0.94180 1.00000
Mg2 Mg 0.36882 0.36882 0.24430 1.00000
Mg3 Mg 0.36331 0.36331 0.80738 1.00000
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