Ho2B3Ru2
Alexandria ALEXAlex-ID: agm003312596 · 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
A2B2C3_100_spg12
HoB2Ru Ho4Ru3 HoRu2
2022-02-04 12:25:05.394793
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003312596).
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 agm003312596
data_agm003312596
_cell_length_a 3.67834
_cell_length_b 5.63076
_cell_length_c 5.82678
_cell_angle_alpha 119.11302
_cell_angle_beta 90.00000
_cell_angle_gamma 109.06429
_cell_volume 97.79069
_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 0.87582 0.75165 0.22517 1.00000
Ho2 Ho 0.12418 0.24835 0.77483 1.00000
B1 B 0.50000 0.00000 0.00000 1.00000
B2 B 0.59962 0.19925 0.36860 1.00000
B3 B 0.40038 0.80075 0.63140 1.00000
Ru1 Ru 0.83422 0.66844 0.70449 1.00000
Ru2 Ru 0.16578 0.33156 0.29551 1.00000
获取直接链接