CeHo7Tm4
Alexandria ALEXAlex-ID: agm006094615 · 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
AB4C7_189_spg2
HoTm2 Ho7Tm2 Ce
2023-08-15 20:41:03.501750
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006094615).
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 agm006094615
data_agm006094615
_cell_length_a 5.88984
_cell_length_b 9.01571
_cell_length_c 9.90498
_cell_angle_alpha 74.80915
_cell_angle_beta 89.90537
_cell_angle_gamma 49.23281
_cell_volume 373.95627
_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
Ce1 Ce 0.00000 0.00000 0.00000 1.00000
Ho1 Ho 0.71080 0.53924 0.92197 1.00000
Ho2 Ho 0.28920 0.46076 0.07803 1.00000
Ho3 Ho 0.06522 0.18763 0.62577 1.00000
Ho4 Ho 0.93478 0.81237 0.37423 1.00000
Ho5 Ho 0.52912 0.71396 0.57306 1.00000
Ho6 Ho 0.50000 0.00000 0.00000 1.00000
Ho7 Ho 0.47088 0.28604 0.42694 1.00000
Tm1 Tm 0.65761 0.59504 0.27378 1.00000
Tm2 Tm 0.34239 0.40496 0.72622 1.00000
Tm3 Tm 0.87757 0.86934 0.72645 1.00000
Tm4 Tm 0.12243 0.13066 0.27355 1.00000
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