AcLa(Pr2Ho)2
Alexandria ALEXAlex-ID: agm004771374 · 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
ABC2D4_601_spg12
LaHo2 Ac Pr
2022-07-16 19:25:12.853321
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004771374).
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 agm004771374
data_agm004771374
_cell_length_a 6.16582
_cell_length_b 5.78195
_cell_length_c 10.46481
_cell_angle_alpha 66.76353
_cell_angle_beta 72.86658
_cell_angle_gamma 57.77840
_cell_volume 288.30936
_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
Ac1 Ac 0.50000 0.50000 0.50000 1.00000
La1 La 0.00000 0.00000 0.00000 1.00000
Pr1 Pr 0.12493 0.11250 0.63764 1.00000
Pr2 Pr 0.37610 0.36697 0.88083 1.00000
Pr3 Pr 0.87507 0.88750 0.36236 1.00000
Pr4 Pr 0.62390 0.63303 0.11917 1.00000
Ho1 Ho 0.75487 0.74537 0.74490 1.00000
Ho2 Ho 0.24513 0.25463 0.25510 1.00000
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