TmZnGa
Alexandria ALEXAlex-ID: agm069381069 · 空间群: Ima2 (#46)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC_46_spg71
TmZnGa
2024-12-24 03:04:19
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm069381069).
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
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# CIF generated by HEAS from Alexandria entry agm069381069
data_agm069381069
_cell_length_a 5.61881
_cell_length_b 5.61881
_cell_length_c 5.61881
_cell_angle_alpha 133.89366
_cell_angle_beta 102.53647
_cell_angle_gamma 95.14156
_cell_volume 117.29147
_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
Tm1 Tm 0.67680 0.97424 0.20256 1.00000
Tm2 Tm 0.22832 0.02576 0.70256 1.00000
Zn1 Zn 0.08379 0.66920 0.91459 1.00000
Zn2 Zn 0.24539 0.33080 0.41459 1.00000
Ga1 Ga 0.64541 0.66022 0.48519 1.00000
Ga2 Ga 0.82498 0.33978 0.98519 1.00000
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