LaDy(AlNi2)2
Alexandria ALEXAlex-ID: agm034622720 · 空间群: R-3m (#166)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC2D4_78_spg166
DyAl3Ni2 Dy3(AlNi3)2 La3Ni4 AlNi
2024-11-09 09:46:40.406210
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm034622720).
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
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# CIF generated by HEAS from Alexandria entry agm034622720
data_agm034622720
_cell_length_a 9.63465
_cell_length_b 9.63465
_cell_length_c 9.63465
_cell_angle_alpha 25.05571
_cell_angle_beta 25.05571
_cell_angle_gamma 25.05571
_cell_volume 141.12549
_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 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.50000 0.50000 0.50000 1.00000
Al1 Al 0.75495 0.75495 0.75495 1.00000
Al2 Al 0.24505 0.24505 0.24505 1.00000
Ni1 Ni 0.40259 0.40259 0.40259 1.00000
Ni2 Ni 0.89683 0.89683 0.89683 1.00000
Ni3 Ni 0.10317 0.10317 0.10317 1.00000
Ni4 Ni 0.59741 0.59741 0.59741 1.00000
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