Rb3Er2ScTe6
Alexandria ALEXAlex-ID: agm034343789 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_376_spg12
RbScTe2 RbErTe2
2025-01-19 06:05:08
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm034343789).
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 agm034343789
data_agm034343789
_cell_length_a 10.90075
_cell_length_b 10.90075
_cell_length_c 9.95391
_cell_angle_alpha 68.49470
_cell_angle_beta 111.50530
_cell_angle_gamma 156.45069
_cell_volume 438.18450
_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 0.50000 0.50000 0.50000 1.00000
Rb2 Rb 0.16797 0.83203 0.83426 1.00000
Rb3 Rb 0.83203 0.16797 0.16574 1.00000
Er1 Er 0.16505 0.83495 0.33110 1.00000
Er2 Er 0.83495 0.16505 0.66890 1.00000
Sc1 Sc 0.50000 0.50000 0.00000 1.00000
Te1 Te 0.65091 0.34909 0.10749 1.00000
Te2 Te 0.32178 0.67822 0.44456 1.00000
Te3 Te 0.34909 0.65091 0.89251 1.00000
Te4 Te 0.99039 0.00961 0.78959 1.00000
Te5 Te 0.00961 0.99039 0.21041 1.00000
Te6 Te 0.67822 0.32178 0.55544 1.00000
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