Mg2SbWO6
Alexandria ALEXAlex-ID: agm005506953 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_2082_spg1
MgWO4 Mg(SbO2)2 Mg3WO6 Sb
2023-03-20 14:55:09.777671
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005506953).
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
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# CIF generated by HEAS from Alexandria entry agm005506953
data_agm005506953
_cell_length_a 5.66664
_cell_length_b 5.67502
_cell_length_c 5.43787
_cell_angle_alpha 120.79634
_cell_angle_beta 69.93799
_cell_angle_gamma 112.72466
_cell_volume 136.20485
_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
Mg1 Mg 0.10489 0.97783 0.52766 1.00000
Mg2 Mg 0.69997 0.94565 0.25296 1.00000
Sb1 Sb 0.27236 0.65160 0.85560 1.00000
W1 W 0.64799 0.26248 0.93628 1.00000
O1 O 0.93218 0.65874 0.16200 1.00000
O2 O 0.39820 0.04957 0.20047 1.00000
O3 O 0.85167 0.02697 0.90004 1.00000
O4 O 0.89690 0.26130 0.57778 1.00000
O5 O 0.39227 0.95704 0.67171 1.00000
O6 O 0.46715 0.54081 0.06975 1.00000
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