Pm5(PrHo)2
Alexandria ALEXAlex-ID: agm005563271 · 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
A2B2C5_491_spg2
Pm3Ho5 Pm2Ho7 Pm2Pr
2023-06-03 05:24:44.089803
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005563271).
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 agm005563271
data_agm005563271
_cell_length_a 6.29013
_cell_length_b 9.64896
_cell_length_c 9.63967
_cell_angle_alpha 141.93698
_cell_angle_beta 108.94601
_cell_angle_gamma 90.07876
_cell_volume 306.24342
_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
Pm1 Pm 0.44476 0.88752 0.22375 1.00000
Pm2 Pm 0.55524 0.11248 0.77625 1.00000
Pm3 Pm 0.11204 0.22136 0.55680 1.00000
Pm4 Pm 0.88796 0.77864 0.44320 1.00000
Pm5 Pm 0.00000 0.00000 0.00000 1.00000
Pr1 Pr 0.33394 0.66662 0.66628 1.00000
Pr2 Pr 0.66606 0.33338 0.33372 1.00000
Ho1 Ho 0.22074 0.44563 0.10971 1.00000
Ho2 Ho 0.77926 0.55437 0.89029 1.00000
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