SrYVSbO6
Alexandria ALEXAlex-ID: agm011645558 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCDE6_46_spg66
Sr3V2O8 YVO3 Y3Sb5O12 Y2O3 Sb
2024-05-31 22:27:35.720922
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011645558).
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}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm011645558
data_agm011645558
_cell_length_a 5.54706
_cell_length_b 5.92052
_cell_length_c 8.07102
_cell_angle_alpha 90.48841
_cell_angle_beta 90.84778
_cell_angle_gamma 89.36267
_cell_volume 265.00959
_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
Sr1 Sr 0.00923 0.05519 0.74628 1.00000
Sr2 Sr 0.99077 0.94481 0.25372 1.00000
Y1 Y 0.46829 0.56688 0.74520 1.00000
Y2 Y 0.53171 0.43312 0.25480 1.00000
V1 V 0.50000 0.00000 0.00000 1.00000
V2 V 0.00000 0.50000 0.50000 1.00000
Sb1 Sb 0.00000 0.50000 0.00000 1.00000
Sb2 Sb 0.50000 0.00000 0.50000 1.00000
O1 O 0.79823 0.22994 0.05848 1.00000
O2 O 0.69397 0.67297 0.44586 1.00000
O3 O 0.20177 0.77006 0.94152 1.00000
O4 O 0.30603 0.32703 0.55414 1.00000
O5 O 0.70298 0.69231 0.06360 1.00000
O6 O 0.81255 0.22346 0.44358 1.00000
O7 O 0.29702 0.30769 0.93640 1.00000
O8 O 0.18745 0.77654 0.55642 1.00000
O9 O 0.58642 0.93907 0.76964 1.00000
O10 O 0.87345 0.47535 0.76253 1.00000
O11 O 0.41358 0.06093 0.23036 1.00000
O12 O 0.12655 0.52465 0.23747 1.00000
Get direct link