LaTb2(DyHo2)2
Alexandria ALEXAlex-ID: agm023104666 · 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
AB2C2D4_332_spg12
TbDy5 Tb2Ho Tb2DyHo6 LaHo2
2024-12-03 09:37:22
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm023104666).
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 agm023104666
data_agm023104666
_cell_length_a 9.49155
_cell_length_b 9.49155
_cell_length_c 9.53933
_cell_angle_alpha 64.87271
_cell_angle_beta 115.12729
_cell_angle_gamma 158.18896
_cell_volume 287.90530
_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
La1 La 0.00000 0.00000 0.00000 1.00000
Tb1 Tb 0.33141 0.66859 0.99808 1.00000
Tb2 Tb 0.66859 0.33141 0.00192 1.00000
Dy1 Dy 0.85227 0.14773 0.33489 1.00000
Dy2 Dy 0.14773 0.85227 0.66511 1.00000
Ho1 Ho 0.81403 0.18597 0.66357 1.00000
Ho2 Ho 0.18597 0.81403 0.33643 1.00000
Ho3 Ho 0.51916 0.48084 0.33686 1.00000
Ho4 Ho 0.48084 0.51916 0.66314 1.00000
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