Ba2La5Pt4
Alexandria ALEXAlex-ID: agm012597296 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_748_spg12
La4Pt3 LaPt Ba
2024-05-28 08:33:17.112088
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012597296).
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 agm012597296
data_agm012597296
_cell_length_a 9.67273
_cell_length_b 9.67273
_cell_length_c 10.65523
_cell_angle_alpha 59.24165
_cell_angle_beta 59.24165
_cell_angle_gamma 25.07351
_cell_volume 359.85389
_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
Ba1 Ba 0.55136 0.55136 0.60821 1.00000
Ba2 Ba 0.44864 0.44864 0.39179 1.00000
La1 La 0.74222 0.74222 0.68825 1.00000
La2 La 0.25778 0.25778 0.31175 1.00000
La3 La 0.84746 0.84746 0.94097 1.00000
La4 La 0.50000 0.50000 0.00000 1.00000
La5 La 0.15254 0.15254 0.05903 1.00000
Pt1 Pt 0.32214 0.32214 0.77607 1.00000
Pt2 Pt 0.88725 0.88725 0.21263 1.00000
Pt3 Pt 0.67786 0.67786 0.22393 1.00000
Pt4 Pt 0.11275 0.11275 0.78737 1.00000
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