Y8Ga2Os
Alexandria ALEXAlex-ID: agm003528056 · 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
AB2C8_19_spg12
Y3Os Y3Ga2 Y
2022-03-15 07:36:12.730771
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003528056).
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 agm003528056
data_agm003528056
_cell_length_a 5.04673
_cell_length_b 6.72073
_cell_length_c 9.35552
_cell_angle_alpha 104.51139
_cell_angle_beta 105.64756
_cell_angle_gamma 90.00000
_cell_volume 295.03116
_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
Y1 Y 0.41073 0.56057 0.82146 1.00000
Y2 Y 0.65489 0.96427 0.30978 1.00000
Y3 Y 0.79489 0.68909 0.58979 1.00000
Y4 Y 0.97562 0.21257 0.95124 1.00000
Y5 Y 0.20511 0.31091 0.41021 1.00000
Y6 Y 0.34511 0.03573 0.69022 1.00000
Y7 Y 0.58927 0.43943 0.17854 1.00000
Y8 Y 0.02438 0.78743 0.04876 1.00000
Ga1 Ga 0.81269 0.26576 0.62538 1.00000
Ga2 Ga 0.18731 0.73424 0.37462 1.00000
Os1 Os 0.50000 0.00000 0.00000 1.00000
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