Tb5Ho6
Alexandria ALEXAlex-ID: agm003293126 · 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
A5B6_66_spg12
Tb2Ho7 Tb2Ho
2022-01-17 03:40:53.381231
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003293126).
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 agm003293126
data_agm003293126
_cell_length_a 9.02895
_cell_length_b 7.88770
_cell_length_c 6.29207
_cell_angle_alpha 80.09805
_cell_angle_beta 72.51516
_cell_angle_gamma 55.08618
_cell_volume 350.47633
_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
Tb1 Tb 0.50000 0.00000 0.50000 1.00000
Tb2 Tb 0.37126 0.25748 0.00000 1.00000
Tb3 Tb 0.62874 0.74252 1.00000 1.00000
Tb4 Tb 0.24031 0.51937 0.50000 1.00000
Tb5 Tb 0.75969 0.48063 0.50000 1.00000
Ho1 Ho 0.83462 0.00000 0.68697 1.00000
Ho2 Ho 0.16538 1.00000 0.31303 1.00000
Ho3 Ho 0.31021 0.73655 0.82918 1.00000
Ho4 Ho 0.95323 0.73655 0.17082 1.00000
Ho5 Ho 0.68979 0.26345 0.17082 1.00000
Ho6 Ho 0.04677 0.26345 0.82918 1.00000
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