Li5Fe2Cu3O10
Alexandria ALEXAlex-ID: agm005281563 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5D10_1_spg2
LiCuO2 LiFeO2
2023-05-08 04:39:51.419590
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005281563).
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 agm005281563
data_agm005281563
_cell_length_a 5.04497
_cell_length_b 5.22943
_cell_length_c 7.60619
_cell_angle_alpha 106.52953
_cell_angle_beta 102.56266
_cell_angle_gamma 102.39736
_cell_volume 179.38082
_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 0.20611 0.90807 0.40125 1.00000
Li2 Li 0.39808 0.28455 0.78839 1.00000
Li3 Li 0.50000 0.50000 0.50000 1.00000
Li4 Li 0.60192 0.71545 0.21161 1.00000
Li5 Li 0.79389 0.09193 0.59875 1.00000
Fe1 Fe 0.10201 0.68673 0.69329 1.00000
Fe2 Fe 0.89799 0.31327 0.30671 1.00000
Cu1 Cu 0.00000 0.50000 0.00000 1.00000
Cu2 Cu 0.69748 0.89437 0.89976 1.00000
Cu3 Cu 0.30252 0.10563 0.10024 1.00000
O1 O 0.06016 0.04440 0.83898 1.00000
O2 O 0.33572 0.68828 0.93822 1.00000
O3 O 0.13016 0.32490 0.54388 1.00000
O4 O 0.21431 0.50111 0.23952 1.00000
O5 O 0.43771 0.88043 0.66072 1.00000
O6 O 0.56229 0.11957 0.33928 1.00000
O7 O 0.78569 0.49889 0.76048 1.00000
O8 O 0.86984 0.67510 0.45612 1.00000
O9 O 0.66428 0.31172 0.06178 1.00000
O10 O 0.93984 0.95560 0.16102 1.00000
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