DyTm2Sb3
Alexandria ALEXAlex-ID: agm017240928 · 空间群: Pnma (#62)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2C3_1824_spg62
DyTm3Sb4 Dy3TmSb4
2025-01-21 20:16:08
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017240928).
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 agm017240928
data_agm017240928
_cell_length_a 6.15443
_cell_length_b 8.68657
_cell_length_c 13.07991
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 699.26285
_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 0.75000 0.87481 0.58236 1.00000
Dy2 Dy 0.75000 0.37481 0.91764 1.00000
Dy3 Dy 0.25000 0.62519 0.08236 1.00000
Dy4 Dy 0.25000 0.12519 0.41764 1.00000
Tm1 Tm 0.75000 0.87502 0.25125 1.00000
Tm2 Tm 0.75000 0.37502 0.24875 1.00000
Tm3 Tm 0.75000 0.87524 0.91634 1.00000
Tm4 Tm 0.75000 0.37524 0.58366 1.00000
Tm5 Tm 0.25000 0.62476 0.41634 1.00000
Tm6 Tm 0.25000 0.12476 0.08366 1.00000
Tm7 Tm 0.25000 0.62498 0.75125 1.00000
Tm8 Tm 0.25000 0.12498 0.74875 1.00000
Sb1 Sb 0.75000 0.62732 0.08421 1.00000
Sb2 Sb 0.75000 0.12732 0.41579 1.00000
Sb3 Sb 0.75000 0.62274 0.41562 1.00000
Sb4 Sb 0.75000 0.12274 0.08438 1.00000
Sb5 Sb 0.75000 0.62503 0.75015 1.00000
Sb6 Sb 0.75000 0.12503 0.74985 1.00000
Sb7 Sb 0.25000 0.87497 0.25015 1.00000
Sb8 Sb 0.25000 0.37497 0.24985 1.00000
Sb9 Sb 0.25000 0.87726 0.91562 1.00000
Sb10 Sb 0.25000 0.37726 0.58438 1.00000
Sb11 Sb 0.25000 0.87268 0.58421 1.00000
Sb12 Sb 0.25000 0.37268 0.91579 1.00000
