Tb2Dy4Mg5
Alexandria ALEXAlex-ID: agm003366254 · 空间群: Fmmm (#69)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B4C5_154_spg69
TbDyMg2 Dy2Mg
2022-02-05 08:49:55.819699
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003366254).
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 agm003366254
data_agm003366254
_cell_length_a 6.20943
_cell_length_b 5.90546
_cell_length_c 11.50908
_cell_angle_alpha 81.84662
_cell_angle_beta 74.34990
_cell_angle_gamma 58.28221
_cell_volume 345.69208
_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
Tb1 Tb 0.88572 0.00000 0.22857 1.00000
Tb2 Tb 0.11428 1.00000 0.77143 1.00000
Dy1 Dy 0.45861 0.33484 0.74794 1.00000
Dy2 Dy 0.54139 0.66516 0.25206 1.00000
Dy3 Dy 0.20655 0.33484 0.25206 1.00000
Dy4 Dy 0.79345 0.66516 0.74794 1.00000
Mg1 Mg 0.50000 0.00000 0.00000 1.00000
Mg2 Mg 0.00000 0.50000 0.00000 1.00000
Mg3 Mg 0.50000 0.50000 0.00000 1.00000
Mg4 Mg 0.25000 0.50000 0.50000 1.00000
Mg5 Mg 0.75000 0.50000 0.50000 1.00000
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