Tb2Er2Tm5
Alexandria ALEXAlex-ID: agm009133003 · 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
A2B2C5_1070_spg2
Tb5Er ErTm5 Tb3(Er2Tm)2
2024-05-05 20:21:41.055361
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009133003).
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 agm009133003
data_agm009133003
_cell_length_a 9.34182
_cell_length_b 9.34182
_cell_length_c 8.67972
_cell_angle_alpha 76.51272
_cell_angle_beta 76.51272
_cell_angle_gamma 21.79833
_cell_volume 273.23245
_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
Tb1 Tb 0.66649 0.66649 0.49884 1.00000
Tb2 Tb 0.33351 0.33351 0.50116 1.00000
Er1 Er 0.07393 0.07393 0.83486 1.00000
Er2 Er 0.92607 0.92607 0.16514 1.00000
Tm1 Tm 0.59249 0.59249 0.16533 1.00000
Tm2 Tm 0.40751 0.40751 0.83467 1.00000
Tm3 Tm 0.74066 0.74066 0.83548 1.00000
Tm4 Tm 0.25934 0.25934 0.16452 1.00000
Tm5 Tm 0.00000 0.00000 0.50000 1.00000
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