Dy4Ho5Er2
Alexandria ALEXAlex-ID: agm005651817 · 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
A2B4C5_290_spg12
Dy3(Ho2Er)2 Dy2Ho5Er2 Dy5Ho
2023-06-24 06:38:16.724854
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005651817).
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 agm005651817
data_agm005651817
_cell_length_a 3.61747
_cell_length_b 9.82160
_cell_length_c 12.54611
_cell_angle_alpha 123.83549
_cell_angle_beta 81.72947
_cell_angle_gamma 111.62606
_cell_volume 343.11035
_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
Dy1 Dy 0.75412 0.42587 0.34302 1.00000
Dy2 Dy 0.32609 0.35305 0.05422 1.00000
Dy3 Dy 0.24588 0.57413 0.65698 1.00000
Dy4 Dy 0.67391 0.64695 0.94578 1.00000
Ho1 Ho 0.92067 0.03850 0.23612 1.00000
Ho2 Ho 0.07933 0.96150 0.76388 1.00000
Ho3 Ho 0.57858 0.82813 0.49823 1.00000
Ho4 Ho 0.50000 0.00000 0.00000 1.00000
Ho5 Ho 0.42142 0.17187 0.50177 1.00000
Er1 Er 0.89209 0.27788 0.77165 1.00000
Er2 Er 0.10791 0.72212 0.22835 1.00000
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