K2Zn4Fe2Si4O15
Alexandria ALEXAlex-ID: agm010164964 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C4D4E15_2_spg44
Fe2SiO4 K2Zn(SiO3)2 K2Zn(Si2O5)2 ZnO
2025-01-27 11:27:41
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010164964).
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 agm010164964
data_agm010164964
_cell_length_a 9.54381
_cell_length_b 9.54381
_cell_length_c 9.54381
_cell_angle_alpha 147.87700
_cell_angle_beta 123.22105
_cell_angle_gamma 66.74780
_cell_volume 381.98000
_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 0.11639 0.18732 0.07093 1.00000
K2 K 0.88361 0.95455 0.07093 1.00000
Zn1 Zn 0.49501 0.28115 0.16322 1.00000
Zn2 Zn 0.11792 0.28115 0.78613 1.00000
Zn3 Zn 0.88208 0.66821 0.16322 1.00000
Zn4 Zn 0.50499 0.66821 0.78613 1.00000
Fe1 Fe 0.66028 0.11537 0.77565 1.00000
Fe2 Fe 0.33972 0.11537 0.45509 1.00000
Si1 Si 0.17478 0.56004 0.73483 1.00000
Si2 Si 0.82522 0.56004 0.38526 1.00000
Si3 Si 0.69176 0.17971 0.48796 1.00000
Si4 Si 0.30824 0.79620 0.48796 1.00000
O1 O 0.00000 0.46785 0.46785 1.00000
O2 O 0.18070 0.86389 0.04459 1.00000
O3 O 0.81930 0.86389 0.68320 1.00000
O4 O 0.71425 0.89211 0.17786 1.00000
O5 O 0.28575 0.46361 0.17786 1.00000
O6 O 0.40859 0.94903 0.54044 1.00000
O7 O 0.59141 0.13184 0.54044 1.00000
O8 O 0.17098 0.33431 0.66507 1.00000
O9 O 0.66924 0.33431 0.16333 1.00000
O10 O 0.82902 0.49409 0.16333 1.00000
O11 O 0.33076 0.49409 0.66507 1.00000
O12 O 0.41290 0.88282 0.76748 1.00000
O13 O 0.88466 0.35458 0.76748 1.00000
O14 O 0.11534 0.88282 0.46991 1.00000
O15 O 0.58710 0.35458 0.46991 1.00000
