TlZnInNiPt
Alexandria ALEXAlex-ID: agm002114656 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCDE_669_spg8
In2Pt Zn2NiPt Tl Ni
2021-11-11 20:42:54.817356
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002114656).
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 agm002114656
data_agm002114656
_cell_length_a 3.50394
_cell_length_b 4.86462
_cell_length_c 6.74616
_cell_angle_alpha 104.81854
_cell_angle_beta 89.78631
_cell_angle_gamma 111.36012
_cell_volume 103.01814
_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
Tl1 Tl 0.09522 0.93608 0.56719 1.00000
Zn1 Zn 0.29173 0.31414 0.21943 1.00000
In1 In 0.91387 0.56040 0.90236 1.00000
Ni1 Ni 0.80814 0.34914 0.50523 1.00000
Pt1 Pt 0.56845 0.87132 0.19161 1.00000
