Nb4Pt3Au4
Alexandria ALEXAlex-ID: agm009643487 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_138_spg2
NbPt NbAu3 Au
2024-04-19 12:35:22.887902
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009643487).
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 agm009643487
data_agm009643487
_cell_length_a 16.01511
_cell_length_b 16.01511
_cell_length_c 16.01511
_cell_angle_alpha 169.67593
_cell_angle_beta 165.26410
_cell_angle_gamma 18.02559
_cell_volume 187.23701
_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 0.45491 0.45491 0.00000 1.00000
Nb2 Nb 0.54509 0.54509 0.00000 1.00000
Nb3 Nb 0.17930 0.17930 0.00000 1.00000
Nb4 Nb 0.82070 0.82070 0.00000 1.00000
Pt1 Pt 0.36246 0.36246 0.00000 1.00000
Pt2 Pt 0.63754 0.63754 0.00000 1.00000
Pt3 Pt 0.00000 0.00000 0.00000 1.00000
Au1 Au 0.90979 0.90979 0.00000 1.00000
Au2 Au 0.72698 0.72698 0.00000 1.00000
Au3 Au 0.27302 0.27302 0.00000 1.00000
Au4 Au 0.09021 0.09021 0.00000 1.00000
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