LaTm3Ni2
Alexandria ALEXAlex-ID: agm015607142 · 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_993_spg12
Tm3Ni TmNi La
2025-04-14 04:59:53
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm015607142).
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 agm015607142
data_agm015607142
_cell_length_a 3.91924
_cell_length_b 8.28408
_cell_length_c 9.79749
_cell_angle_alpha 78.44056
_cell_angle_beta 78.49845
_cell_angle_gamma 76.33263
_cell_volume 298.93411
_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
La1 La 0.84955 0.55582 0.74634 1.00000
La2 La 0.15045 0.44418 0.25366 1.00000
Tm1 Tm 0.15282 0.94278 0.75183 1.00000
Tm2 Tm 0.84718 0.05722 0.24817 1.00000
Tm3 Tm 0.41782 0.21567 0.94832 1.00000
Tm4 Tm 0.58218 0.78433 0.05168 1.00000
Tm5 Tm 0.58756 0.26257 0.56379 1.00000
Tm6 Tm 0.41244 0.73743 0.43621 1.00000
Ni1 Ni 0.23110 0.59313 0.94540 1.00000
Ni2 Ni 0.76890 0.40687 0.05460 1.00000
Ni3 Ni 0.76802 0.91462 0.54901 1.00000
Ni4 Ni 0.23198 0.08538 0.45099 1.00000
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