Y8TcPt2
Alexandria ALEXAlex-ID: agm006010998 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_281_spg12
Y3Pt Y3Tc Y2Pt
2023-10-01 21:32:31
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006010998).
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 agm006010998
data_agm006010998
_cell_length_a 5.81456
_cell_length_b 7.67663
_cell_length_c 7.67663
_cell_angle_alpha 113.23529
_cell_angle_beta 100.00706
_cell_angle_gamma 100.00707
_cell_volume 298.74937
_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 0.57891 0.32807 0.07915 1.00000
Y2 Y 0.57891 0.07915 0.32807 1.00000
Y3 Y 0.17311 0.36205 0.36205 1.00000
Y4 Y 0.99121 0.21539 0.78339 1.00000
Y5 Y 0.99121 0.78339 0.21539 1.00000
Y6 Y 0.81466 0.64669 0.64669 1.00000
Y7 Y 0.38671 0.92626 0.67620 1.00000
Y8 Y 0.38671 0.67620 0.92626 1.00000
Tc1 Tc 0.10398 0.00369 0.00369 1.00000
Pt1 Pt 0.49713 0.69552 0.31752 1.00000
Pt2 Pt 0.49713 0.31752 0.69552 1.00000
Get direct link