LaTm(AlNi2)2
Alexandria ALEXAlex-ID: agm032303045 · 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
TmAlNi Tm3(AlNi3)2 La3Ni4 AlNi
2024-11-09 09:50:36.311665
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm032303045).
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 agm032303045
data_agm032303045
_cell_length_a 9.53252
_cell_length_b 9.53252
_cell_length_c 9.53252
_cell_angle_alpha 25.29828
_cell_angle_beta 25.29828
_cell_angle_gamma 25.29828
_cell_volume 139.21204
_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
Tm1 Tm 0.50000 0.50000 0.50000 1.00000
Al1 Al 0.75618 0.75618 0.75618 1.00000
Al2 Al 0.24382 0.24382 0.24382 1.00000
Ni1 Ni 0.40314 0.40314 0.40314 1.00000
Ni2 Ni 0.89521 0.89521 0.89521 1.00000
Ni3 Ni 0.10479 0.10479 0.10479 1.00000
Ni4 Ni 0.59686 0.59686 0.59686 1.00000
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