Y2Tm
Alexandria ALEXAlex-ID: agm015960993 · 空间群: P-1 (#2)
基础信息
组成
能量与稳定性
电子结构
其他信息
AB2_6914_spg2
Y5Tm YTm2
2025-03-02 05:18:44
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm015960993).
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 agm015960993
data_agm015960993
_cell_length_a 6.68758
_cell_length_b 7.24652
_cell_length_c 8.41459
_cell_angle_alpha 89.95950
_cell_angle_beta 102.28497
_cell_angle_gamma 105.72378
_cell_volume 382.83354
_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
Y1 Y 0.44693 0.73715 0.19544 1.00000
Y2 Y 0.44314 0.23513 0.19517 1.00000
Y3 Y 0.88945 0.59698 0.14065 1.00000
Y4 Y 0.21990 0.92911 0.47385 1.00000
Y5 Y 0.78010 0.07089 0.52615 1.00000
Y6 Y 0.11055 0.40302 0.85935 1.00000
Y7 Y 0.55307 0.26285 0.80456 1.00000
Y8 Y 0.55686 0.76487 0.80483 1.00000
Tm1 Tm 0.77769 0.56863 0.52899 1.00000
Tm2 Tm 0.89076 0.09794 0.13772 1.00000
Tm3 Tm 0.22231 0.43137 0.47101 1.00000
Tm4 Tm 0.10924 0.90206 0.86228 1.00000
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