Tb2Ce(DyFe)2
Alexandria ALEXAlex-ID: agm024440665 · 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
AB2C2D2_67_spg12
Tb2CeFe TbDy3Fe8 Tb5Dy CeDy2Fe
2025-05-02 09:14:42
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024440665).
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 agm024440665
data_agm024440665
_cell_length_a 3.65938
_cell_length_b 6.23553
_cell_length_c 8.10997
_cell_angle_alpha 72.96492
_cell_angle_beta 77.14958
_cell_angle_gamma 73.07802
_cell_volume 167.36169
_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 0.37787 0.80597 0.93502 1.00000
Tb2 Tb 0.62213 0.19403 0.06498 1.00000
Ce1 Ce 0.50000 0.00000 0.50000 1.00000
Dy1 Dy 0.16636 0.47653 0.68937 1.00000
Dy2 Dy 0.83364 0.52347 0.31063 1.00000
Fe1 Fe 0.16400 0.88822 0.28992 1.00000
Fe2 Fe 0.83600 0.11178 0.71008 1.00000
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