Ho3TmC2
Alexandria ALEXAlex-ID: agm020168629 · 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
AB2C3_986_spg12
Ho3TmC2
2025-04-15 05:41:22
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020168629).
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
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# CIF generated by HEAS from Alexandria entry agm020168629
data_agm020168629
_cell_length_a 8.16274
_cell_length_b 8.16274
_cell_length_c 12.37395
_cell_angle_alpha 50.75942
_cell_angle_beta 129.24058
_cell_angle_gamma 154.78291
_cell_volume 267.47771
_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 0.85992 0.14008 0.80020 1.00000
Ho2 Ho 0.14008 0.85992 0.19980 1.00000
Ho3 Ho 0.63987 0.36013 0.94957 1.00000
Ho4 Ho 0.36013 0.63987 0.05043 1.00000
Ho5 Ho 0.36082 0.63918 0.55073 1.00000
Ho6 Ho 0.63918 0.36082 0.44927 1.00000
Tm1 Tm 0.14091 0.85909 0.70025 1.00000
Tm2 Tm 0.85909 0.14091 0.29975 1.00000
C1 C 0.74891 0.25109 0.87356 1.00000
C2 C 0.25109 0.74891 0.12644 1.00000
C3 C 0.24943 0.75057 0.62480 1.00000
C4 C 0.75057 0.24943 0.37520 1.00000
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