Nd2Ho5Cd2
Alexandria ALEXAlex-ID: agm009869559 · 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
A2B2C5_118_spg12
Ho2Cd NdHo2 Nd
2024-05-11 00:28:25.974419
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009869559).
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 agm009869559
data_agm009869559
_cell_length_a 6.63630
_cell_length_b 6.63630
_cell_length_c 11.91794
_cell_angle_alpha 71.86369
_cell_angle_beta 71.86369
_cell_angle_gamma 32.91600
_cell_volume 269.77821
_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
Nd1 Nd 0.01327 0.01327 0.16423 1.00000
Nd2 Nd 0.98673 0.98673 0.83577 1.00000
Ho1 Ho 0.69060 0.69060 0.91373 1.00000
Ho2 Ho 0.30940 0.30940 0.08627 1.00000
Ho3 Ho 0.31428 0.31428 0.37959 1.00000
Ho4 Ho 0.68572 0.68572 0.62041 1.00000
Ho5 Ho 0.00000 0.00000 0.50000 1.00000
Cd1 Cd 0.34898 0.34898 0.70242 1.00000
Cd2 Cd 0.65102 0.65102 0.29758 1.00000
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