YbV2O6
Alexandria ALEXAlex-ID: agm002175353 · 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
AB2C6_13_spg12
V2O5 Yb2V2O7
2018-06-09 11:54:43
引用参考
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002175353).
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 agm002175353
data_agm002175353
_cell_length_a 3.65378
_cell_length_b 5.07987
_cell_length_c 7.10948
_cell_angle_alpha 112.35150
_cell_angle_beta 90.00513
_cell_angle_gamma 111.06993
_cell_volume 112.44335
_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
Yb1 Yb 0.00000 0.00000 0.00000 1.00000
O1 O 0.69858 0.39714 0.56661 1.00000
O2 O 0.30142 0.60286 0.43339 1.00000
O3 O 0.33615 0.67220 0.87014 1.00000
O4 O 0.02788 0.05554 0.69278 1.00000
O5 O 0.66385 0.32780 0.12986 1.00000
O6 O 0.97212 0.94445 0.30722 1.00000
V1 V 0.18512 0.37028 0.63335 1.00000
V2 V 0.81488 0.62972 0.36665 1.00000
获取直接链接