Ho5Te5Au
Alexandria ALEXAlex-ID: agm003673535 · 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
AB5C5_0_spg12
Ho3Te4 Ho5Te6 HoAu
2022-04-09 18:13:26.705254
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003673535).
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 agm003673535
data_agm003673535
_cell_length_a 6.12793
_cell_length_b 7.51047
_cell_length_c 8.57373
_cell_angle_alpha 107.02437
_cell_angle_beta 90.00000
_cell_angle_gamma 114.07668
_cell_volume 341.23870
_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 0.84266 0.68532 0.16049 1.00000
Ho2 Ho 0.84227 0.68454 0.67767 1.00000
Ho3 Ho 0.50000 0.00000 0.00000 1.00000
Ho4 Ho 0.15773 0.31546 0.32233 1.00000
Ho5 Ho 0.15734 0.31468 0.83951 1.00000
Te1 Te 0.67656 0.35313 0.33544 1.00000
Te2 Te 0.66557 0.33113 0.82752 1.00000
Te3 Te 0.00000 0.00000 0.50000 1.00000
Te4 Te 0.33443 0.66887 0.17248 1.00000
Te5 Te 0.32344 0.64687 0.66456 1.00000
Au1 Au 0.00000 0.00000 0.00000 1.00000
获取直接链接