Ho5Ge5Rh2
Alexandria ALEXAlex-ID: agm005665355 · 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
A2B5C5_26_spg12
Ho2Ge2Rh HoGe
2023-06-19 00:14:02.323879
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005665355).
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 agm005665355
data_agm005665355
_cell_length_a 4.21799
_cell_length_b 7.84010
_cell_length_c 8.37041
_cell_angle_alpha 89.41859
_cell_angle_beta 75.40656
_cell_angle_gamma 74.39516
_cell_volume 257.50729
_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 0.00000 0.50000 0.50000 1.00000
Ho2 Ho 0.69855 0.68302 0.91988 1.00000
Ho3 Ho 0.36961 0.93884 0.32195 1.00000
Ho4 Ho 0.63039 0.06116 0.67805 1.00000
Ho5 Ho 0.30145 0.31698 0.08012 1.00000
Ge1 Ge 0.72030 0.22000 0.33939 1.00000
Ge2 Ge 0.95032 0.29411 0.80524 1.00000
Ge3 Ge 0.04968 0.70589 0.19476 1.00000
Ge4 Ge 0.27970 0.78000 0.66061 1.00000
Ge5 Ge 0.00000 0.00000 0.00000 1.00000
Rh1 Rh 0.39305 0.46398 0.74992 1.00000
Rh2 Rh 0.60695 0.53602 0.25008 1.00000
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