La2Dy2YEr4
Alexandria ALEXAlex-ID: agm024847528 · 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_91_spg2
Dy5Er4 LaDy4 LaY2 LaEr2
2025-01-03 21:57:07
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024847528).
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 agm024847528
data_agm024847528
_cell_length_a 9.52448
_cell_length_b 9.52448
_cell_length_c 9.56985
_cell_angle_alpha 64.80683
_cell_angle_beta 115.19317
_cell_angle_gamma 158.16861
_cell_volume 290.92568
_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 0.33423 0.66577 0.00241 1.00000
La2 La 0.66577 0.33423 0.99759 1.00000
Dy1 Dy 0.85271 0.14729 0.33807 1.00000
Dy2 Dy 0.14729 0.85271 0.66193 1.00000
Y1 Y 0.00000 0.00000 0.00000 1.00000
Er1 Er 0.81441 0.18559 0.66174 1.00000
Er2 Er 0.18559 0.81441 0.33826 1.00000
Er3 Er 0.52012 0.47988 0.33757 1.00000
Er4 Er 0.47988 0.52012 0.66243 1.00000
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