Ho4MgCd3
Alexandria ALEXAlex-ID: agm017302500 · 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
AB3C4_344_spg139
Ho3MgCd2 HoCd
2024-11-15 07:12:00.267661
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017302500).
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 agm017302500
data_agm017302500
_cell_length_a 8.41353
_cell_length_b 8.41353
_cell_length_c 8.41353
_cell_angle_alpha 143.56355
_cell_angle_beta 143.56355
_cell_angle_gamma 52.48045
_cell_volume 208.85426
_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
Ho1 Ho 0.87402 0.37402 0.50000 1.00000
Ho2 Ho 0.12598 0.62598 0.50000 1.00000
Ho3 Ho 0.62598 0.12598 0.50000 1.00000
Ho4 Ho 0.37402 0.87402 0.50000 1.00000
Mg1 Mg 0.00000 0.00000 0.00000 1.00000
Cd1 Cd 0.50000 0.50000 0.00000 1.00000
Cd2 Cd 0.24840 0.24840 0.00000 1.00000
Cd3 Cd 0.75160 0.75160 0.00000 1.00000
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