K2Tm(GeO3)2
Alexandria ALEXAlex-ID: agm004569784 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D6_0_spg12
KTm(GeO3)2 K3TmGe2O7 Tm2GeO5 Ge
2022-06-24 14:40:43.305723
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004569784).
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 agm004569784
data_agm004569784
_cell_length_a 6.01729
_cell_length_b 5.95272
_cell_length_c 6.87762
_cell_angle_alpha 116.49827
_cell_angle_beta 90.00000
_cell_angle_gamma 120.35947
_cell_volume 181.94672
_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 0.70592 0.41184 0.16838 1.00000
K2 K 0.29408 0.58816 0.83162 1.00000
Tm1 Tm 0.50000 0.00000 0.50000 1.00000
Ge1 Ge 0.94662 0.89324 0.77928 1.00000
Ge2 Ge 0.05338 0.10676 0.22072 1.00000
O1 O 0.74929 0.49857 0.64309 1.00000
O2 O 0.21396 0.93938 0.24462 1.00000
O3 O 0.27458 0.06062 0.75538 1.00000
O4 O 0.78604 0.06062 0.75538 1.00000
O5 O 0.72542 0.93938 0.24462 1.00000
O6 O 0.25071 0.50143 0.35691 1.00000
Get direct link