Ho3(AlZn)4
Alexandria ALEXAlex-ID: agm005696534 · 空间群: Immm (#71)
基础信息
组成
能量与稳定性
电子结构
其他信息
A3B4C4_125_spg71
HoAlZn2 HoAl2
2023-07-01 23:35:58.875171
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005696534).
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 agm005696534
data_agm005696534
_cell_length_a 3.68340
_cell_length_b 4.37122
_cell_length_c 13.70516
_cell_angle_alpha 80.84517
_cell_angle_beta 82.29625
_cell_angle_gamma 90.04276
_cell_volume 215.83436
_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
Ho1 Ho 0.14587 0.64628 0.70838 1.00000
Ho2 Ho 0.85415 0.35374 0.29163 1.00000
Ho3 Ho 0.00002 0.00002 0.99999 1.00000
Al1 Al 0.59388 0.09431 0.81169 1.00000
Al2 Al 0.25543 0.25456 0.48951 1.00000
Al3 Al 0.74458 0.74546 0.51051 1.00000
Al4 Al 0.40615 0.90572 0.18830 1.00000
Zn1 Zn 0.54716 0.54742 0.90552 1.00000
Zn2 Zn 0.45287 0.45262 0.09445 1.00000
Zn3 Zn 0.31196 0.81172 0.37544 1.00000
Zn4 Zn 0.68806 0.18830 0.62457 1.00000
获取直接链接