Eu5Pd2
Alexandria ALEXAlex-ID: agm005266820 · 空间群: C2/c (#15)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B5_186_spg15
Eu3Pd Eu3Pd2
2022-12-13 04:07:28.229870
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005266820).
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
加载 3D 结构...
# CIF generated by HEAS from Alexandria entry agm005266820
data_agm005266820
_cell_length_a 8.76326
_cell_length_b 8.76326
_cell_length_c 7.56020
_cell_angle_alpha 86.80153
_cell_angle_beta 86.80153
_cell_angle_gamma 53.18553
_cell_volume 463.89840
_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
Eu1 Eu 0.21362 0.00907 0.34875 1.00000
Eu2 Eu 0.99093 0.78638 0.15125 1.00000
Eu3 Eu 0.78638 0.99093 0.65125 1.00000
Eu4 Eu 0.00907 0.21362 0.84875 1.00000
Eu5 Eu 0.74403 0.63004 0.50676 1.00000
Eu6 Eu 0.36996 0.25597 0.99324 1.00000
Eu7 Eu 0.25597 0.36996 0.49324 1.00000
Eu8 Eu 0.63004 0.74403 0.00676 1.00000
Eu9 Eu 0.65507 0.34493 0.25000 1.00000
Eu10 Eu 0.34493 0.65507 0.75000 1.00000
Pd1 Pd 0.01046 0.58711 0.81403 1.00000
Pd2 Pd 0.41289 0.98954 0.68597 1.00000
Pd3 Pd 0.98954 0.41289 0.18597 1.00000
Pd4 Pd 0.58711 0.01046 0.31403 1.00000
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