Li4Fe3Bi2Pt3O16
Alexandria ALEXAlex-ID: agm010197979 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3D4E16_0_spg8
Li4Fe3Bi2Pt3O16
2024-12-31 10:32:53
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010197979).
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 agm010197979
data_agm010197979
_cell_length_a 6.19508
_cell_length_b 6.19508
_cell_length_c 10.27705
_cell_angle_alpha 89.96144
_cell_angle_beta 90.03856
_cell_angle_gamma 119.72672
_cell_volume 342.51743
_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
Li1 Li 0.32557 0.67443 0.10334 1.00000
Li2 Li 0.00433 0.99567 0.00103 1.00000
Li3 Li 0.00260 0.99740 0.50605 1.00000
Li4 Li 0.66299 0.33701 0.62821 1.00000
Fe1 Fe 0.17052 0.33682 0.78447 1.00000
Fe2 Fe 0.66318 0.82948 0.78447 1.00000
Fe3 Fe 0.83038 0.16962 0.28337 1.00000
Bi1 Bi 0.34133 0.65867 0.50971 1.00000
Bi2 Bi 0.67486 0.32514 0.99850 1.00000
Pt1 Pt 0.16977 0.83023 0.78555 1.00000
Pt2 Pt 0.33378 0.16851 0.28086 1.00000
Pt3 Pt 0.83149 0.66622 0.28086 1.00000
O1 O 0.14544 0.29481 0.39263 1.00000
O2 O 0.48571 0.51429 0.67192 1.00000
O3 O 0.33499 0.66501 0.89173 1.00000
O4 O 0.00151 0.99850 0.68784 1.00000
O5 O 0.00039 0.99961 0.18353 1.00000
O6 O 0.70519 0.85456 0.39263 1.00000
O7 O 0.02601 0.51170 0.67552 1.00000
O8 O 0.48830 0.97399 0.67552 1.00000
O9 O 0.85277 0.14723 0.89756 1.00000
O10 O 0.14780 0.85220 0.38799 1.00000
O11 O 0.51391 0.02892 0.17092 1.00000
O12 O 0.97108 0.48609 0.17092 1.00000
O13 O 0.66238 0.33762 0.38358 1.00000
O14 O 0.30228 0.14871 0.89422 1.00000
O15 O 0.51187 0.48813 0.17406 1.00000
O16 O 0.85129 0.69772 0.89422 1.00000
