CeY(TlTe2)2
Alexandria ALEXAlex-ID: agm045429176 · 空间群: P2/m (#10)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABC2D4_907_spg6
CeTlTe2 YTlTe2
2024-11-26 11:50:13.928451
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm045429176).
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 agm045429176
data_agm045429176
_cell_length_a 7.83719
_cell_length_b 4.52232
_cell_length_c 8.58659
_cell_angle_alpha 90.00000
_cell_angle_beta 107.62461
_cell_angle_gamma 90.00000
_cell_volume 290.04294
_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
Ce1 Ce 0.50000 0.00000 0.00000 1.00000
Y1 Y 0.00000 0.50000 0.00000 1.00000
Tl1 Tl 0.50000 0.50000 0.50000 1.00000
Tl2 Tl 0.00000 0.00000 0.50000 1.00000
Te1 Te 0.25356 0.50000 0.78191 1.00000
Te2 Te 0.74644 0.50000 0.21809 1.00000
Te3 Te 0.23128 0.00000 0.21478 1.00000
Te4 Te 0.76872 0.00000 0.78522 1.00000
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