Ho2Np3Pt7
Alexandria ALEXAlex-ID: agm024785415 · 空间群: P-1 (#2)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B3C7_828_spg1
Ho3Pt5 HoPt3 NpPt
2025-05-16 13:14:45
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024785415).
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 agm024785415
data_agm024785415
_cell_length_a 5.37031
_cell_length_b 7.09371
_cell_length_c 7.51472
_cell_angle_alpha 67.43137
_cell_angle_beta 69.23441
_cell_angle_gamma 78.74135
_cell_volume 246.59962
_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 0.67681 0.06283 0.65448 1.00000
Ho2 Ho 0.32319 0.93717 0.34552 1.00000
Np1 Np 0.00000 0.00000 0.00000 1.00000
Np2 Np 0.90162 0.50097 0.77975 1.00000
Np3 Np 0.09838 0.49903 0.22025 1.00000
Pt1 Pt 0.50000 0.50000 0.50000 1.00000
Pt2 Pt 0.38736 0.27431 0.94327 1.00000
Pt3 Pt 0.66593 0.28080 0.21900 1.00000
Pt4 Pt 0.17518 0.20062 0.58081 1.00000
Pt5 Pt 0.61264 0.72569 0.05673 1.00000
Pt6 Pt 0.82482 0.79938 0.41919 1.00000
Pt7 Pt 0.33407 0.71920 0.78100 1.00000
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