Y5(GeO6)2
Alexandria ALEXAlex-ID: agm003368166 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_4_spg12
Y2GeO5 YO2
2022-02-07 07:33:09.314360
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003368166).
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 agm003368166
data_agm003368166
_cell_length_a 5.79236
_cell_length_b 6.81707
_cell_length_c 7.28656
_cell_angle_alpha 105.51499
_cell_angle_beta 90.00000
_cell_angle_gamma 115.14070
_cell_volume 248.83658
_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
Y1 Y 0.30546 0.61093 0.64245 1.00000
Y2 Y 0.30617 0.61234 0.16430 1.00000
Y3 Y 0.00000 0.00000 0.50000 1.00000
Y4 Y 0.69383 0.38766 0.83570 1.00000
Y5 Y 0.69454 0.38907 0.35755 1.00000
Ge1 Ge 0.75474 0.00000 0.00000 1.00000
Ge2 Ge 0.24526 1.00000 1.00000 1.00000
O1 O 0.00014 0.00028 0.17865 1.00000
O2 O 0.10003 0.68043 0.91949 1.00000
O3 O 0.58039 0.68043 0.91949 1.00000
O4 O 0.09644 0.69401 0.42446 1.00000
O5 O 0.59757 0.69401 0.42446 1.00000
O6 O 0.50049 0.00098 0.82016 1.00000
O7 O 0.49951 0.99902 0.17984 1.00000
O8 O 0.90356 0.30599 0.57554 1.00000
O9 O 0.40243 0.30599 0.57554 1.00000
O10 O 0.89997 0.31957 0.08051 1.00000
O11 O 0.41961 0.31957 0.08051 1.00000
O12 O 0.99986 0.99972 0.82135 1.00000
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