Yb3Pt4
Alexandria ALEXAlex-ID: agm005254036 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4_36_spg148
Yb2Pt3 YbPt
2023-05-06 21:32:14.245351
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005254036).
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 agm005254036
data_agm005254036
_cell_length_a 7.87197
_cell_length_b 7.87197
_cell_length_c 7.87197
_cell_angle_alpha 114.36414
_cell_angle_beta 114.36414
_cell_angle_gamma 114.36414
_cell_volume 288.19333
_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
Yb1 Yb 0.71627 0.59865 0.97227 1.00000
Yb2 Yb 0.02773 0.28373 0.40135 1.00000
Yb3 Yb 0.97227 0.71627 0.59865 1.00000
Yb4 Yb 0.28373 0.40135 0.02773 1.00000
Yb5 Yb 0.59865 0.97227 0.71627 1.00000
Yb6 Yb 0.40135 0.02773 0.28373 1.00000
Pt1 Pt 0.05812 0.55549 0.22308 1.00000
Pt2 Pt 0.77692 0.94188 0.44451 1.00000
Pt3 Pt 0.22308 0.05812 0.55549 1.00000
Pt4 Pt 0.55549 0.22308 0.05812 1.00000
Pt5 Pt 0.44451 0.77692 0.94188 1.00000
Pt6 Pt 0.94188 0.44451 0.77692 1.00000
Pt7 Pt 0.50000 0.50000 0.50000 1.00000
Pt8 Pt 0.00000 0.00000 0.00000 1.00000
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