YIn5Pt4
Alexandria ALEXAlex-ID: agm006077367 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C5_449_spg12
YInPt2 In2Pt
2023-10-18 09:17:48
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006077367).
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 agm006077367
data_agm006077367
_cell_length_a 4.73305
_cell_length_b 6.76423
_cell_length_c 7.89276
_cell_angle_alpha 114.43356
_cell_angle_beta 107.44771
_cell_angle_gamma 89.99999
_cell_volume 217.22584
_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
Y1 Y 0.50000 0.00000 0.00000 1.00000
In1 In 0.82629 0.32132 0.65259 1.00000
In2 In 0.83490 0.83343 0.66980 1.00000
In3 In 0.16510 0.16657 0.33020 1.00000
In4 In 0.50000 0.50000 0.00000 1.00000
In5 In 0.17371 0.67868 0.34741 1.00000
Pt1 Pt 0.33415 0.57955 0.66830 1.00000
Pt2 Pt 0.00946 0.74630 0.01892 1.00000
Pt3 Pt 0.66585 0.42045 0.33170 1.00000
Pt4 Pt 0.99054 0.25370 0.98108 1.00000
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