Sr4LiMn2(GaO5)2
Alexandria ALEXAlex-ID: agm005236834 · Space group: Fmm2 (#42)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D4E10_50_spg42
Sr4Mn2O7 Sr3Ga4O9 SrMnO2 LiGaO2 SrO
2023-05-07 21:02:14.784526
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005236834).
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 agm005236834
data_agm005236834
_cell_length_a 9.03248
_cell_length_b 8.85763
_cell_length_c 5.86732
_cell_angle_alpha 72.47596
_cell_angle_beta 69.24925
_cell_angle_gamma 38.27479
_cell_volume 271.70011
_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
Sr1 Sr 0.66051 0.05811 0.94189 1.00000
Sr2 Sr 0.37040 0.91747 0.08253 1.00000
Sr3 Sr 0.05811 0.66051 0.33949 1.00000
Sr4 Sr 0.91747 0.37040 0.62960 1.00000
Li1 Li 0.38239 0.38239 0.61761 1.00000
Mn1 Mn 0.49364 0.99678 0.50636 1.00000
Mn2 Mn 0.99678 0.49364 0.00322 1.00000
Ga1 Ga 0.69038 0.32476 0.30962 1.00000
Ga2 Ga 0.32476 0.69038 0.67524 1.00000
O1 O 0.26606 0.26606 0.73394 1.00000
O2 O 0.75025 0.75025 0.74975 1.00000
O3 O 0.25025 0.25025 0.24975 1.00000
O4 O 0.74057 0.74057 0.25943 1.00000
O5 O 0.67509 0.12613 0.32491 1.00000
O6 O 0.31165 0.90146 0.68835 1.00000
O7 O 0.12613 0.67509 0.87387 1.00000
O8 O 0.90146 0.31165 0.09854 1.00000
O9 O 0.65034 0.34481 0.65519 1.00000
O10 O 0.34481 0.65034 0.34966 1.00000
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