Tb2Pm3Ho2
Alexandria ALEXAlex-ID: agm009072997 · 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
A2B2C3_225_spg12
TbPm3Ho4 Tb5Pm3 Pm
2024-05-15 08:24:09.131042
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009072997).
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 agm009072997
data_agm009072997
_cell_length_a 6.20650
_cell_length_b 6.20650
_cell_length_c 8.02290
_cell_angle_alpha 97.41477
_cell_angle_beta 97.41477
_cell_angle_gamma 48.33497
_cell_volume 228.55045
_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
Tb1 Tb 0.85754 0.85754 0.07091 1.00000
Tb2 Tb 0.14246 0.14246 0.92909 1.00000
Pm1 Pm 0.00000 0.00000 0.50000 1.00000
Pm2 Pm 0.71377 0.71377 0.64426 1.00000
Pm3 Pm 0.28623 0.28623 0.35574 1.00000
Ho1 Ho 0.57200 0.57200 0.21072 1.00000
Ho2 Ho 0.42800 0.42800 0.78928 1.00000
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