Dy3Ho2Tm5
Alexandria ALEXAlex-ID: agm005603353 · 空间群: C2/c (#15)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B3C5_183_spg15
Dy5Ho HoTm5 Dy2Ho7
2023-06-16 20:11:51.218878
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005603353).
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 agm005603353
data_agm005603353
_cell_length_a 9.35748
_cell_length_b 9.35577
_cell_length_c 10.94696
_cell_angle_alpha 125.70039
_cell_angle_beta 125.70389
_cell_angle_gamma 68.56034
_cell_volume 631.53692
_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 0.23144 0.98144 0.96289 1.00000
Dy2 Dy 0.76856 0.01856 0.03711 1.00000
Dy3 Dy 0.72930 0.47873 0.25555 1.00000
Dy4 Dy 0.27070 0.52127 0.74445 1.00000
Dy5 Dy 0.02626 0.77682 0.25555 1.00000
Dy6 Dy 0.97374 0.22318 0.74445 1.00000
Ho1 Ho 0.77012 0.01981 0.74169 1.00000
Ho2 Ho 0.22988 0.98019 0.25831 1.00000
Ho3 Ho 0.47157 0.72189 0.74170 1.00000
Ho4 Ho 0.52843 0.27811 0.25830 1.00000
Tm1 Tm 0.27029 0.52029 0.04058 1.00000
Tm2 Tm 0.72971 0.47971 0.95942 1.00000
Tm3 Tm 0.02712 0.77712 0.55424 1.00000
Tm4 Tm 0.52716 0.27716 0.55433 1.00000
Tm5 Tm 0.97288 0.22288 0.44576 1.00000
Tm6 Tm 0.47284 0.72284 0.44567 1.00000
Tm7 Tm 0.86333 0.61263 0.72889 1.00000
Tm8 Tm 0.13667 0.38737 0.27111 1.00000
Tm9 Tm 0.36556 0.11626 0.72889 1.00000
Tm10 Tm 0.63444 0.88374 0.27111 1.00000
