Ho2Zn2Ni
Alexandria ALEXAlex-ID: agm003403292 · 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
AB2C2_1402_spg12
Ho2ZnNi2 HoZn2 Ho2ZnNi
2022-02-11 08:31:31.276715
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003403292).
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}
}
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# CIF generated by HEAS from Alexandria entry agm003403292
data_agm003403292
_cell_length_a 3.78425
_cell_length_b 5.56548
_cell_length_c 10.42866
_cell_angle_alpha 92.85310
_cell_angle_beta 79.54665
_cell_angle_gamma 70.12466
_cell_volume 201.64786
_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 0.66629 0.33295 0.33449 1.00000
Ho2 Ho 0.93109 0.26270 0.87511 1.00000
Ho3 Ho 0.33371 0.66705 0.66551 1.00000
Ho4 Ho 0.06891 0.73730 0.12489 1.00000
Zn1 Zn 0.12391 0.20153 0.55065 1.00000
Zn2 Zn 0.63743 0.83292 0.89222 1.00000
Zn3 Zn 0.87609 0.79847 0.44935 1.00000
Zn4 Zn 0.36257 0.16708 0.10778 1.00000
Ni1 Ni 0.61865 0.07706 0.68563 1.00000
Ni2 Ni 0.38135 0.92294 0.31437 1.00000
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