HoTmSbTe
Alexandria ALEXAlex-ID: agm005190899 · 空间群: R3m (#160)
基础信息
组成
能量与稳定性
电子结构
其他信息
ABCD_113_spg8
Ho2SbTe Tm2SbTe
2022-07-10 17:19:15.135433
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005190899).
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 agm005190899
data_agm005190899
_cell_length_a 4.24695
_cell_length_b 4.24715
_cell_length_c 7.88833
_cell_angle_alpha 90.00131
_cell_angle_beta 105.61075
_cell_angle_gamma 119.99857
_cell_volume 117.12432
_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 0.12410 0.95998 0.09941 1.00000
Tm1 Tm 0.48102 0.13845 0.63476 1.00000
Sb1 Sb 0.30431 0.55007 0.86965 1.00000
Te1 Te 0.96847 0.38230 0.36585 1.00000
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