Pm(HoSb)2
Alexandria ALEXAlex-ID: agm003389321 · 空间群: I4/mmm (#139)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2C2_472_spg12
Pm3Ho2Sb3 Ho5Sb3 PmSb
2022-02-11 20:30:43.090261
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003389321).
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 agm003389321
data_agm003389321
_cell_length_a 4.50081
_cell_length_b 4.50077
_cell_length_c 7.88840
_cell_angle_alpha 106.56754
_cell_angle_beta 106.56783
_cell_angle_gamma 90.34652
_cell_volume 146.13829
_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
Pm1 Pm 0.00000 0.00000 0.00000 1.00000
Ho1 Ho 0.24936 0.75063 0.50000 1.00000
Ho2 Ho 0.75064 0.24937 0.50000 1.00000
Sb1 Sb 0.60251 0.60251 0.20767 1.00000
Sb2 Sb 0.39749 0.39749 0.79233 1.00000
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