Nb4TeAu8
Alexandria ALEXAlex-ID: agm097701774 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1329_spg6
NbAu3 Nb3Te4 NbAu2
2025-06-17 01:26:29
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097701774).
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
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# CIF generated by HEAS from Alexandria entry agm097701774
data_agm097701774
_cell_length_a 4.71603
_cell_length_b 7.86244
_cell_length_c 7.81366
_cell_angle_alpha 119.36702
_cell_angle_beta 89.99896
_cell_angle_gamma 89.99826
_cell_volume 252.49551
_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
Nb1 Nb 0.15385 0.15297 0.08444 1.00000
Nb2 Nb 0.15382 0.41705 0.97474 1.00000
Nb3 Nb 0.65381 0.51363 0.57341 1.00000
Nb4 Nb 0.15385 0.01294 0.68735 1.00000
Te1 Te 0.65391 0.90888 0.84556 1.00000
Au1 Au 0.15387 0.85847 0.23568 1.00000
Au2 Au 0.65383 0.40665 0.17816 1.00000
Au3 Au 0.15383 0.30349 0.54894 1.00000
Au4 Au 0.65386 0.82840 0.43559 1.00000
Au5 Au 0.65386 0.10123 0.28350 1.00000
Au6 Au 0.15383 0.59207 0.42845 1.00000
Au7 Au 0.65386 0.65463 0.00375 1.00000
Au8 Au 0.65383 0.24960 0.72041 1.00000
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