Dy3(TmTl2)2
Alexandria ALEXAlex-ID: agm005691203 · 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
A2B3C4_360_spg12
Dy5Tl4 Dy2Tm3Tl4
2023-06-30 19:41:27.798649
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005691203).
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 agm005691203
data_agm005691203
_cell_length_a 4.83399
_cell_length_b 6.65979
_cell_length_c 9.43089
_cell_angle_alpha 117.63989
_cell_angle_beta 104.84927
_cell_angle_gamma 89.99875
_cell_volume 257.46447
_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 0.11008 0.63303 0.22035 1.00000
Dy2 Dy 0.88992 0.36697 0.77965 1.00000
Dy3 Dy 0.00000 0.00000 0.00000 1.00000
Tm1 Tm 0.67157 0.28111 0.34321 1.00000
Tm2 Tm 0.32843 0.71889 0.65679 1.00000
Tl1 Tl 0.51153 0.73909 0.02301 1.00000
Tl2 Tl 0.25117 0.16914 0.50248 1.00000
Tl3 Tl 0.48847 0.26091 0.97699 1.00000
Tl4 Tl 0.74883 0.83086 0.49752 1.00000
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