EuAl3Ag
Alexandria ALEXAlex-ID: agm088189643 · 空间群: I4mm (#107)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC3_181_spg107
Eu2Al7Ag Eu3Al7Ag2 EuAl3Ag2
2025-03-14 09:32:33
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm088189643).
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}
}
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# CIF generated by HEAS from Alexandria entry agm088189643
data_agm088189643
_cell_length_a 6.46703
_cell_length_b 6.46703
_cell_length_c 6.46703
_cell_angle_alpha 141.05643
_cell_angle_beta 141.05643
_cell_angle_gamma 56.25271
_cell_volume 106.01799
_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
Eu1 Eu 0.86417 0.86417 0.00000 1.00000
Al1 Al 0.62248 0.12248 0.50000 1.00000
Al2 Al 0.12248 0.62248 0.50000 1.00000
Al3 Al 0.26367 0.26367 0.00000 1.00000
Ag1 Ag 0.48937 0.48937 0.00000 1.00000
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