Dy6Tm3Tl
Alexandria ALEXAlex-ID: agm005996471 · 空间群: P2_1/m (#11)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB3C6_1223_spg11
Dy5Tm Dy9Tl4 DyTm5
2023-10-11 22:22:49
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005996471).
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
加载 3D 结构...
# CIF generated by HEAS from Alexandria entry agm005996471
data_agm005996471
_cell_length_a 3.54393
_cell_length_b 13.54070
_cell_length_c 14.18600
_cell_angle_alpha 115.12653
_cell_angle_beta 89.98480
_cell_angle_gamma 89.99006
_cell_volume 616.32954
_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 0.25037 0.44881 0.58357 1.00000
Dy2 Dy 0.74963 0.55119 0.41643 1.00000
Dy3 Dy 0.24985 0.82526 0.14520 1.00000
Dy4 Dy 0.75015 0.17474 0.85480 1.00000
Dy5 Dy 0.24902 0.79620 0.52552 1.00000
Dy6 Dy 0.75098 0.20380 0.47448 1.00000
Dy7 Dy 0.24977 0.64555 0.25855 1.00000
Dy8 Dy 0.75023 0.35445 0.74145 1.00000
Dy9 Dy 0.25008 0.61319 0.85516 1.00000
Dy10 Dy 0.74992 0.38681 0.14484 1.00000
Dy11 Dy 0.24988 0.12574 0.04303 1.00000
Dy12 Dy 0.75012 0.87426 0.95697 1.00000
Tm1 Tm 0.25045 0.08935 0.61922 1.00000
Tm2 Tm 0.74955 0.91065 0.38078 1.00000
Tm3 Tm 0.24986 0.30302 0.31310 1.00000
Tm4 Tm 0.75014 0.69698 0.68690 1.00000
Tm5 Tm 0.25052 0.93940 0.78394 1.00000
Tm6 Tm 0.74948 0.06060 0.21606 1.00000
Tl1 Tl 0.25005 0.39514 0.95034 1.00000
Tl2 Tl 0.74995 0.60486 0.04966 1.00000
