Rb3Ta2Ag3Te8
Alexandria ALEXAlex-ID: agm009306002 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3D8_2_spg15
Rb3Ta2Ag3Te8
2024-12-10 08:35:28
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009306002).
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 agm009306002
data_agm009306002
_cell_length_a 14.05603
_cell_length_b 14.05603
_cell_length_c 16.41061
_cell_angle_alpha 60.34458
_cell_angle_beta 119.65542
_cell_angle_gamma 153.55394
_cell_volume 1243.54944
_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
Rb1 Rb 0.36239 0.75155 0.89933 1.00000
Rb2 Rb 0.63761 0.24845 0.10067 1.00000
Rb3 Rb 0.24845 0.63761 0.39933 1.00000
Rb4 Rb 0.00000 0.00000 0.00000 1.00000
Rb5 Rb 0.75155 0.36239 0.60067 1.00000
Rb6 Rb 0.00000 0.00000 0.50000 1.00000
Ta1 Ta 0.58477 0.83372 0.22300 1.00000
Ta2 Ta 0.16628 0.41523 0.72300 1.00000
Ta3 Ta 0.83372 0.58477 0.27700 1.00000
Ta4 Ta 0.41523 0.16628 0.77700 1.00000
Ag1 Ag 0.72063 0.72063 0.25000 1.00000
Ag2 Ag 0.66603 0.91421 0.72128 1.00000
Ag3 Ag 0.27937 0.27937 0.75000 1.00000
Ag4 Ag 0.08579 0.33397 0.22128 1.00000
Ag5 Ag 0.91421 0.66603 0.77872 1.00000
Ag6 Ag 0.33397 0.08579 0.27872 1.00000
Te1 Te 0.69630 0.27007 0.39204 1.00000
Te2 Te 0.51958 0.44353 0.14930 1.00000
Te3 Te 0.03424 0.83910 0.38465 1.00000
Te4 Te 0.48042 0.55647 0.85070 1.00000
Te5 Te 0.16090 0.96576 0.88465 1.00000
Te6 Te 0.21670 0.90271 0.67930 1.00000
Te7 Te 0.72993 0.30370 0.89204 1.00000
Te8 Te 0.44353 0.51958 0.35070 1.00000
Te9 Te 0.55647 0.48042 0.64930 1.00000
Te10 Te 0.27007 0.69630 0.10796 1.00000
Te11 Te 0.90271 0.21670 0.82070 1.00000
Te12 Te 0.96576 0.16090 0.61535 1.00000
Te13 Te 0.30370 0.72993 0.60796 1.00000
Te14 Te 0.83910 0.03424 0.11535 1.00000
Te15 Te 0.78330 0.09729 0.32070 1.00000
Te16 Te 0.09729 0.78330 0.17930 1.00000
