Rb3Ho3TiTe8
Alexandria ALEXAlex-ID: agm004681663 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3D8_25_spg166
RbHoTe2 TiTe2
2023-02-22 14:30:18.972014
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004681663).
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 agm004681663
data_agm004681663
_cell_length_a 8.71764
_cell_length_b 8.71509
_cell_length_c 10.12697
_cell_angle_alpha 115.49189
_cell_angle_beta 89.99382
_cell_angle_gamma 120.01143
_cell_volume 578.14614
_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 0.00000 0.00000 0.00000 1.00000
Rb2 Rb 0.00000 0.50000 0.00000 1.00000
Rb3 Rb 0.50000 0.50000 0.00000 1.00000
Ho1 Ho 0.50000 0.00000 0.50000 1.00000
Ho2 Ho 0.50000 0.50000 0.50000 1.00000
Ho3 Ho 0.00000 0.50000 0.50000 1.00000
Ti1 Ti 0.00000 0.00000 0.50000 1.00000
Te1 Te 0.26658 0.53310 0.29980 1.00000
Te2 Te 0.73342 0.46690 0.70020 1.00000
Te3 Te 0.78185 0.56365 0.31243 1.00000
Te4 Te 0.21815 0.43635 0.68757 1.00000
Te5 Te 0.78188 0.03051 0.31248 1.00000
Te6 Te 0.21812 0.96949 0.68752 1.00000
Te7 Te 0.24868 0.03051 0.31246 1.00000
Te8 Te 0.75132 0.96949 0.68754 1.00000
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