Ho4In5Pd2
Alexandria ALEXAlex-ID: agm002351069 · 空间群: P2/m (#10)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B4C5_19_spg10
Ho5(In2Pd)2 HoIn3 HoInPd
2019-02-25 14:46:27
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002351069).
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 agm002351069
data_agm002351069
_cell_length_a 3.61766
_cell_length_b 7.70594
_cell_length_c 9.67266
_cell_angle_alpha 94.57438
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 268.79060
_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 0.50000 0.22491 0.43824 1.00000
Ho2 Ho 0.50000 0.81927 0.14225 1.00000
Ho3 Ho 0.50000 0.77509 0.56176 1.00000
Ho4 Ho 0.50000 0.18073 0.85775 1.00000
Pd1 Pd 0.00000 0.92626 0.36159 1.00000
Pd2 Pd 0.00000 0.07374 0.63841 1.00000
In1 In 0.00000 0.45499 0.67676 1.00000
In2 In 0.00000 0.82933 0.85146 1.00000
In3 In 0.00000 0.50000 0.00000 1.00000
In4 In 0.00000 0.17067 0.14854 1.00000
In5 In 0.00000 0.54501 0.32324 1.00000
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