Ti5Te
Alexandria ALEXAlex-ID: agm001192572 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5_8_spg65
Ti5Te4 Ti
2021-05-16 23:00:47
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm001192572).
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 agm001192572
data_agm001192572
_cell_length_a 4.00973
_cell_length_b 4.02610
_cell_length_c 6.89831
_cell_angle_alpha 106.96684
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 106.51636
_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
Te1 Te 0.00000 0.00000 0.00000 1.00000
Ti1 Ti 0.50000 0.82818 0.65636 1.00000
Ti2 Ti 0.00000 0.67209 0.34418 1.00000
Ti3 Ti 0.50000 0.50000 0.00000 1.00000
Ti4 Ti 0.00000 0.32791 0.65582 1.00000
Ti5 Ti 0.50000 0.17182 0.34364 1.00000
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