Al5Ge2
Alexandria ALEXAlex-ID: agm010034563 · 空间群: P-1 (#2)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B5_515_spg1
Ge Al
2024-03-10 01:15:44.604937
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010034563).
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 agm010034563
data_agm010034563
_cell_length_a 5.37284
_cell_length_b 4.92637
_cell_length_c 4.87605
_cell_angle_alpha 99.66953
_cell_angle_beta 96.48544
_cell_angle_gamma 104.94431
_cell_volume 121.25988
_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
Al1 Al 0.14388 0.57658 0.28307 1.00000
Al2 Al 0.85612 0.42342 0.71693 1.00000
Al3 Al 0.00000 0.00000 0.00000 1.00000
Al4 Al 0.42596 0.71910 0.85495 1.00000
Al5 Al 0.57404 0.28090 0.14505 1.00000
Ge1 Ge 0.71812 0.84372 0.42501 1.00000
Ge2 Ge 0.28188 0.15628 0.57499 1.00000
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