K2SnO6
Alexandria ALEXAlex-ID: agm005243885 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_6_spg121
K2O3 K2Sn3O7 KO4
2024-10-07 23:41:33
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005243885).
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 agm005243885
data_agm005243885
_cell_length_a 14.18474
_cell_length_b 3.18552
_cell_length_c 6.05548
_cell_angle_alpha 121.79693
_cell_angle_beta 134.05561
_cell_angle_gamma 76.98458
_cell_volume 162.60494
_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
K1 K 0.27102 0.23010 0.00206 1.00000
K2 K 0.72898 0.76990 0.99794 1.00000
Sn1 Sn 0.00000 0.00000 0.00000 1.00000
O1 O 0.50850 0.87994 0.38859 1.00000
O2 O 0.94489 0.37126 0.31551 1.00000
O3 O 0.13629 0.65975 0.29589 1.00000
O4 O 0.49150 0.12006 0.61141 1.00000
O5 O 0.05511 0.62874 0.68449 1.00000
O6 O 0.86371 0.34025 0.70411 1.00000
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