Ho3Tm2Cd3
Alexandria ALEXAlex-ID: agm003328486 · 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
A2B3C3_16_spg71
Ho3Cd2 HoTmCd2 HoTmCd
2022-01-22 15:48:49.491041
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003328486).
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 agm003328486
data_agm003328486
_cell_length_a 3.69949
_cell_length_b 5.30802
_cell_length_c 11.46557
_cell_angle_alpha 103.38401
_cell_angle_beta 99.28411
_cell_angle_gamma 90.00000
_cell_volume 216.00095
_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 0.62407 0.62407 0.24815 1.00000
Ho2 Ho 0.37593 0.37593 0.75185 1.00000
Ho3 Ho 0.50000 0.00000 0.00000 1.00000
Tm1 Tm 0.73400 0.23400 0.46801 1.00000
Tm2 Tm 0.26600 0.76600 0.53199 1.00000
Cd1 Cd 0.11787 0.11787 0.23573 1.00000
Cd2 Cd 0.00000 0.50000 0.00000 1.00000
Cd3 Cd 0.88213 0.88213 0.76427 1.00000
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