Ni(Te3Pt)2
Alexandria ALEXAlex-ID: agm005689482 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_990_spg12
NiTe2 Te2Pt
2023-07-08 23:31:48.874378
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005689482).
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 agm005689482
data_agm005689482
_cell_length_a 4.00054
_cell_length_b 6.33554
_cell_length_c 11.34585
_cell_angle_alpha 114.37010
_cell_angle_beta 90.00001
_cell_angle_gamma 108.40438
_cell_volume 245.70699
_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
Ni1 Ni 0.00000 0.00000 0.50000 1.00000
Te1 Te 0.99611 0.99222 0.72641 1.00000
Te2 Te 0.66964 0.33927 0.07213 1.00000
Te3 Te 0.33036 0.66073 0.92787 1.00000
Te4 Te 0.65470 0.30940 0.58996 1.00000
Te5 Te 0.34530 0.69060 0.41004 1.00000
Te6 Te 0.00389 0.00778 0.27359 1.00000
Pt1 Pt 0.66259 0.32518 0.83065 1.00000
Pt2 Pt 0.33741 0.67482 0.16935 1.00000
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