Al7V3Cu2
Alexandria ALEXAlex-ID: agm002252139 · 空间群: R3 (#146)
基础信息
组成
能量与稳定性
电子结构
其他信息
A2B3C7_68_spg146
Al2VCu Al3V
2019-01-04 17:55:34
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002252139).
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 agm002252139
data_agm002252139
_cell_length_a 5.00071
_cell_length_b 5.00093
_cell_length_c 8.73515
_cell_angle_alpha 73.38788
_cell_angle_beta 73.38397
_cell_angle_gamma 60.01529
_cell_volume 178.60136
_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
Al1 Al 0.41395 0.06171 0.76098 1.00000
Al2 Al 0.06206 0.76291 0.76115 1.00000
Al3 Al 0.76358 0.41319 0.76125 1.00000
Al4 Al 0.49499 0.49515 0.51506 1.00000
Al5 Al 0.41858 0.41826 0.24044 1.00000
Al6 Al 0.92263 0.41889 0.24027 1.00000
Al7 Al 0.41811 0.92284 0.24032 1.00000
Cu1 Cu 0.33929 0.33915 0.98288 1.00000
Cu2 Cu 0.66965 0.67004 0.98989 1.00000
V1 V 0.97513 0.97518 0.07440 1.00000
V2 V 0.16204 0.16222 0.51263 1.00000
V3 V 0.85991 0.86040 0.42065 1.00000
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